4-(Pyrrolidin-1-ylmethyl)benzylamine
TL;DR: 4-(Pyrrolidin-1-ylmethyl)benzylamine (CAS 91271-79-3) is a chemical compound with molecular formula C12H18N2 and molecular weight 190.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(pyrrolidin-1-ylmethyl)phenyl]methanamine
Also Known As: 4-Pyrrolidin-1-ylmethyl-benzylamine, 4- benzylamine, 4-(Pyrrolidin-1-ylmethyl)benzylamine, [4-(pyrrolidin-1-ylmethyl)phenyl]methanamine, 1-[4-(pyrrolidin-1-ylmethyl)phenyl]methanamine
| Molecular Formula | C12H18N2 |
|---|---|
| Molecular Weight | 190.15 g/mol |
| LogP | 1.7411 |
| Topological Polar Surface Area | 29.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 190.147 |
| Heavy Atoms | 14 |
| Complexity | 272.87814 |
Chemical Identifiers
| CAS Number | 91271-79-3 |
|---|---|
| SMILES | C1CCN(C1)CC2=CC=C(C=C2)CN |
Product Overview
4-(Pyrrolidin-1-ylmethyl)benzylamine (CAS 91271-79-3), with molecular formula C12H18N2 and molecular weight 190.15 g/mol. IUPAC: [4-(pyrrolidin-1-ylmethyl)phenyl]methanamine.
Chemical Property Profile of 4-(Pyrrolidin-1-ylmethyl)benzylamine
Property Insights of 4-(Pyrrolidin-1-ylmethyl)benzylamine
The XLogP value of 1.7411 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Pyrrolidin-1-ylmethyl)benzylamine. With a topological polar surface area (TPSA) of 29.26 Ų, 4-(Pyrrolidin-1-ylmethyl)benzylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Pyrrolidin-1-ylmethyl)benzylamine 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 4-(Pyrrolidin-1-ylmethyl)benzylamine?
The CAS number of 4-(Pyrrolidin-1-ylmethyl)benzylamine is 91271-79-3.
What is the molecular formula of 4-(Pyrrolidin-1-ylmethyl)benzylamine?
The molecular formula of 4-(Pyrrolidin-1-ylmethyl)benzylamine is C12H18N2.
What is the molecular weight of 4-(Pyrrolidin-1-ylmethyl)benzylamine?
The molecular weight of 4-(Pyrrolidin-1-ylmethyl)benzylamine is 190.15 g/mol.
Where can I buy 4-(Pyrrolidin-1-ylmethyl)benzylamine?
You can request a quote for 4-(Pyrrolidin-1-ylmethyl)benzylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Pyrrolidin-1-ylmethyl)benzylamine?
Yes, KEHONG BIO provides custom synthesis services for 4-(Pyrrolidin-1-ylmethyl)benzylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.