1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
TL;DR: 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide (CAS 680181-77-5) is a chemical compound with molecular formula C12H16N4O and molecular weight 232.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-N-propan-2-yl-5-pyrrol-1-ylpyrazole-4-carboxamide
Also Known As: Maybridge3_001567, IDI1_012954, 1-methyl-N-propan-2-yl-5-pyrrol-1-ylpyrazole-4-carboxamide, N-isopropyl-1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide, 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
| Molecular Formula | C12H16N4O |
|---|---|
| Molecular Weight | 232.13 g/mol |
| LogP | 1.349 |
| Topological Polar Surface Area | 51.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.13242 |
| Heavy Atoms | 17 |
| Complexity | 510.60294 |
Chemical Identifiers
| CAS Number | 680181-77-5 |
|---|---|
| SMILES | CC(C)NC(=O)C1=C(N(N=C1)C)N2C=CC=C2 |
Product Overview
1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide (CAS 680181-77-5), with molecular formula C12H16N4O and molecular weight 232.13 g/mol. IUPAC: 1-methyl-N-propan-2-yl-5-pyrrol-1-ylpyrazole-4-carboxamide.
Chemical Property Profile of 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Property Insights of 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
The XLogP value of 1.349 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide. With a topological polar surface area (TPSA) of 51.85 Ų, 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide 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 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide?
The CAS number of 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide is 680181-77-5.
What is the molecular formula of 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide?
The molecular formula of 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide is C12H16N4O.
What is the molecular weight of 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide?
The molecular weight of 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide is 232.13 g/mol.
Where can I buy 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide?
You can request a quote for 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-methyl-N-(propan-2-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.