(4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine
TL;DR: (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine (CAS 774555-32-7) is a chemical compound with molecular formula C13H15FN2 and molecular weight 218.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine
Also Known As: (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine, BAS 10796075, N-(4-Fluorobenzyl)-1-(1H-pyrrol-2-yl)ethanamine, 1-(4-fluorophenyl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine, [(4-fluorophenyl)methyl][(1-methylpyrrol-2-yl)methyl]amine
| Molecular Formula | C13H15FN2 |
|---|---|
| Molecular Weight | 218.12 g/mol |
| LogP | 2.454 |
| Topological Polar Surface Area | 16.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 218.12193 |
| Heavy Atoms | 16 |
| Complexity | 445.2111 |
Chemical Identifiers
| CAS Number | 774555-32-7 |
|---|---|
| SMILES | CN1C=CC=C1CNCC2=CC=C(C=C2)F |
Product Overview
(4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine (CAS 774555-32-7), with molecular formula C13H15FN2 and molecular weight 218.12 g/mol. IUPAC: 1-(4-fluorophenyl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine.
Chemical Property Profile of (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine
Property Insights of (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine
The XLogP value of 2.454 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine. With a topological polar surface area (TPSA) of 16.96 Ų, (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-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 (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine?
The CAS number of (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine is 774555-32-7.
What is the molecular formula of (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine?
The molecular formula of (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine is C13H15FN2.
What is the molecular weight of (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine?
The molecular weight of (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine is 218.12 g/mol.
Where can I buy (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine?
You can request a quote for (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine?
Yes, KEHONG BIO provides custom synthesis services for (4-Fluoro-benzyl)-(1-methyl-1H-pyrrol-2-ylmethyl)-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.