1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide
TL;DR: 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide (CAS 680181-79-7) is a chemical compound with molecular formula C12H14N4O and molecular weight 230.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide
Also Known As: Maybridge3_001655, IDI1_013042, 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide, 1-methyl-N-(prop-2-en-1-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide, N-allyl-1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
| Molecular Formula | C12H14N4O |
|---|---|
| Molecular Weight | 230.12 g/mol |
| LogP | 1.1266 |
| Topological Polar Surface Area | 51.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.11676 |
| Heavy Atoms | 17 |
| Complexity | 524.70294 |
Chemical Identifiers
| CAS Number | 680181-79-7 |
|---|---|
| SMILES | CN1C(=C(C=N1)C(=O)NCC=C)N2C=CC=C2 |
Product Overview
1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide (CAS 680181-79-7), with molecular formula C12H14N4O and molecular weight 230.12 g/mol. IUPAC: 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide.
Chemical Property Profile of 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide
Property Insights of 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide
The XLogP value of 1.1266 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide. With a topological polar surface area (TPSA) of 51.85 Ų, 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide has 1 hydrogen bond donor(s) and 2 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 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide?
The CAS number of 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide is 680181-79-7.
What is the molecular formula of 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide?
The molecular formula of 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide is C12H14N4O.
What is the molecular weight of 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide?
The molecular weight of 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide is 230.12 g/mol.
Where can I buy 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide?
You can request a quote for 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-methyl-N-prop-2-enyl-5-pyrrol-1-ylpyrazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.