Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine
TL;DR: Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine (CAS 893572-85-5) is a chemical compound with molecular formula C12H22N2 and molecular weight 194.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1-methylpyrrol-2-yl)methyl]hexan-1-amine
Also Known As: Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine, N-[(1-methylpyrrol-2-yl)methyl]hexan-1-amine, hexyl(1-methyl-1H-pyrrol-2-yl)methylamine
| Molecular Formula | C12H22N2 |
|---|---|
| Molecular Weight | 194.18 g/mol |
| LogP | 2.695 |
| Topological Polar Surface Area | 16.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 194.1783 |
| Heavy Atoms | 14 |
| Complexity | 240.2247 |
Chemical Identifiers
| CAS Number | 893572-85-5 |
|---|---|
| SMILES | CCCCCCNCC1=CC=CN1C |
Product Overview
Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine (CAS 893572-85-5), with molecular formula C12H22N2 and molecular weight 194.18 g/mol. IUPAC: N-[(1-methylpyrrol-2-yl)methyl]hexan-1-amine.
Chemical Property Profile of Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine
Property Insights of Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine
The XLogP value of 2.695 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine. With a topological polar surface area (TPSA) of 16.96 Ų, Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine 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 Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine?
The CAS number of Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine is 893572-85-5.
What is the molecular formula of Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine?
The molecular formula of Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine is C12H22N2.
What is the molecular weight of Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine?
The molecular weight of Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine is 194.18 g/mol.
Where can I buy Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine?
You can request a quote for Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine?
Yes, KEHONG BIO provides custom synthesis services for Hexyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.