3-(1H-Pyrrol-1-Yl)Benzylamine
TL;DR: 3-(1H-Pyrrol-1-Yl)Benzylamine (CAS 368869-95-8) is a chemical compound with molecular formula C11H12N2 and molecular weight 172.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-pyrrol-1-ylphenyl)methanamine
Also Known As: 3-(1H-Pyrrol-1-Yl)Benzylamine, (3-pyrrol-1-ylphenyl)methanamine, (3-(1h-pyrrol-1-yl)phenyl)methanamine, 3- BENZYLAMINE, 3-pyrrol-1-yl-benzylamine
| Molecular Formula | C11H12N2 |
|---|---|
| Molecular Weight | 172.10 g/mol |
| LogP | 1.936 |
| Topological Polar Surface Area | 30.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.10005 |
| Heavy Atoms | 13 |
| Complexity | 376.74863 |
Chemical Identifiers
| CAS Number | 368869-95-8 |
|---|---|
| SMILES | C1=CN(C=C1)C2=CC=CC(=C2)CN |
Product Overview
3-(1H-Pyrrol-1-Yl)Benzylamine (CAS 368869-95-8), with molecular formula C11H12N2 and molecular weight 172.10 g/mol. IUPAC: (3-pyrrol-1-ylphenyl)methanamine.
Chemical Property Profile of 3-(1H-Pyrrol-1-Yl)Benzylamine
Property Insights of 3-(1H-Pyrrol-1-Yl)Benzylamine
The XLogP value of 1.936 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1H-Pyrrol-1-Yl)Benzylamine. With a topological polar surface area (TPSA) of 30.95 Ų, 3-(1H-Pyrrol-1-Yl)Benzylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1H-Pyrrol-1-Yl)Benzylamine 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 3-(1H-Pyrrol-1-Yl)Benzylamine?
The CAS number of 3-(1H-Pyrrol-1-Yl)Benzylamine is 368869-95-8.
What is the molecular formula of 3-(1H-Pyrrol-1-Yl)Benzylamine?
The molecular formula of 3-(1H-Pyrrol-1-Yl)Benzylamine is C11H12N2.
What is the molecular weight of 3-(1H-Pyrrol-1-Yl)Benzylamine?
The molecular weight of 3-(1H-Pyrrol-1-Yl)Benzylamine is 172.10 g/mol.
Where can I buy 3-(1H-Pyrrol-1-Yl)Benzylamine?
You can request a quote for 3-(1H-Pyrrol-1-Yl)Benzylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1H-Pyrrol-1-Yl)Benzylamine?
Yes, KEHONG BIO provides custom synthesis services for 3-(1H-Pyrrol-1-Yl)Benzylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.