3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine
TL;DR: 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine (CAS 43070-87-7) is a chemical compound with molecular formula C13H16N2 and molecular weight 200.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,5-dimethylpyrrol-1-yl)-4-methylaniline
Also Known As: 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine, 3-(2,5-Dimethyl-1H-pyrrol-1-yl)-4-methylaniline, 3-(2,5-dimethylpyrrol-1-yl)-4-methylaniline, TIMTEC-BB SBB010994, BAS 01305899
| Molecular Formula | C13H16N2 |
|---|---|
| Molecular Weight | 200.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 31.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 200.13135 |
| Heavy Atoms | 15 |
| Complexity | 207.0 |
Chemical Identifiers
| CAS Number | 43070-87-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N)N2C(=CC=C2C)C |
| InChIKey | RKORJKONKLIMLO-UHFFFAOYSA-N |
Product Overview
3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine (CAS 43070-87-7), with molecular formula C13H16N2 and molecular weight 200.13 g/mol. IUPAC: 3-(2,5-dimethylpyrrol-1-yl)-4-methylaniline.
Chemical Property Profile of 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine
Property Insights of 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine. With a topological polar surface area (TPSA) of 31.0 Ų, 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine 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-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine?
The CAS number of 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine is 43070-87-7.
What is the molecular formula of 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine?
The molecular formula of 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine is C13H16N2.
What is the molecular weight of 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine?
The molecular weight of 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine is 200.13 g/mol.
Where can I buy 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine?
You can request a quote for 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,5-Dimethyl-pyrrol-1-yl)-4-methyl-phenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.