(1,5-dimethyl-1H-pyrrol-2-yl)methanamine
TL;DR: (1,5-dimethyl-1H-pyrrol-2-yl)methanamine (CAS 96901-77-8) is a chemical compound with molecular formula C7H12N2 and molecular weight 124.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,5-dimethylpyrrol-2-yl)methanamine
Also Known As: (1,5-dimethyl-1H-pyrrol-2-yl)methylamine, (1,5-Dimethyl-1H-pyrrol-2-yl)methanamine, (1,5-dimethylpyrrol-2-yl)methanamine, [(1,5-dimethyl-1H-pyrrol-2-yl)methyl]amine, ZERO/004678
| Molecular Formula | C7H12N2 |
|---|---|
| Molecular Weight | 124.10 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 31.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 124.10005 |
| Heavy Atoms | 9 |
| Complexity | 92.0 |
Chemical Identifiers
| CAS Number | 96901-77-8 |
|---|---|
| SMILES | CC1=CC=C(N1C)CN |
| InChIKey | KMUHAJOXPNPERW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(1,5-dimethyl-1H-pyrrol-2-yl)methanamine (CAS 96901-77-8), with molecular formula C7H12N2 and molecular weight 124.10 g/mol. IUPAC: (1,5-dimethylpyrrol-2-yl)methanamine.
Chemical Property Profile of (1,5-dimethyl-1H-pyrrol-2-yl)methanamine
Property Insights of (1,5-dimethyl-1H-pyrrol-2-yl)methanamine
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1,5-dimethyl-1H-pyrrol-2-yl)methanamine. With a topological polar surface area (TPSA) of 31.0 Ų, (1,5-dimethyl-1H-pyrrol-2-yl)methanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1,5-dimethyl-1H-pyrrol-2-yl)methanamine has 1 hydrogen bond donor(s) and 1 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 (1,5-dimethyl-1H-pyrrol-2-yl)methanamine?
The CAS number of (1,5-dimethyl-1H-pyrrol-2-yl)methanamine is 96901-77-8.
What is the molecular formula of (1,5-dimethyl-1H-pyrrol-2-yl)methanamine?
The molecular formula of (1,5-dimethyl-1H-pyrrol-2-yl)methanamine is C7H12N2.
What is the molecular weight of (1,5-dimethyl-1H-pyrrol-2-yl)methanamine?
The molecular weight of (1,5-dimethyl-1H-pyrrol-2-yl)methanamine is 124.10 g/mol.
Where can I buy (1,5-dimethyl-1H-pyrrol-2-yl)methanamine?
You can request a quote for (1,5-dimethyl-1H-pyrrol-2-yl)methanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,5-dimethyl-1H-pyrrol-2-yl)methanamine?
Yes, KEHONG BIO provides custom synthesis services for (1,5-dimethyl-1H-pyrrol-2-yl)methanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.