(2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile
TL;DR: (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile (CAS 333322-38-6) is a chemical compound with molecular formula C19H25N3O2 and molecular weight 327.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)-2-(morpholine-4-carbonyl)prop-2-enenitrile
Also Known As: (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile, (E)-3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)-2-(morpholine-4-carbonyl)prop-2-enenitrile, (E)-3-(1-Cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholine-4-carbonyl)-acrylonitrile, (E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholine-4-carbonyl)acrylonitrile, 3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholine-4-carbonyl)prop-2-enenitrile
| Molecular Formula | C19H25N3O2 |
|---|---|
| Molecular Weight | 327.19 g/mol |
| LogP | 2.98582 |
| Topological Polar Surface Area | 58.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.19467 |
| Heavy Atoms | 24 |
| Complexity | 684.20044 |
Chemical Identifiers
| CAS Number | 333322-38-6 |
|---|---|
| SMILES | CC1=CC(=C(N1C2CCCC2)C)/C=C(\C#N)/C(=O)N3CCOCC3 |
Product Overview
(2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile (CAS 333322-38-6), with molecular formula C19H25N3O2 and molecular weight 327.19 g/mol. IUPAC: (E)-3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)-2-(morpholine-4-carbonyl)prop-2-enenitrile.
Chemical Property Profile of (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile
Property Insights of (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile
The XLogP value of 2.98582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile. With a topological polar surface area (TPSA) of 58.26 Ų, (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile?
The CAS number of (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile is 333322-38-6.
What is the molecular formula of (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile?
The molecular formula of (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile is C19H25N3O2.
What is the molecular weight of (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile?
The molecular weight of (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile is 327.19 g/mol.
Where can I buy (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile?
You can request a quote for (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-(1-cyclopentyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.