N-Methyl-1H-imidazole-4-carboxamide
TL;DR: N-Methyl-1H-imidazole-4-carboxamide (CAS 53525-55-6) is a chemical compound with molecular formula C5H7N3O and molecular weight 125.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-1H-imidazole-5-carboxamide
Also Known As: N-Methyl-1H-imidazole-5-carboxamide, ISOBUTYLLITHIUM, 1H-Imidazole-5-carboxamide, N-methyl-, 1H-Imidazole-5-carboxamide,N-methyl, 1H-Imidazole-5-carboxamide,N-methyl-
| Molecular Formula | C5H7N3O |
|---|---|
| Molecular Weight | 125.06 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 57.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 125.058914 |
| Heavy Atoms | 9 |
| Complexity | 115.0 |
Chemical Identifiers
| CAS Number | 53525-55-6 |
|---|---|
| SMILES | CNC(=O)C1=CN=CN1 |
| InChIKey | FLFMCBMWUDAGSD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Methyl-1H-imidazole-4-carboxamide (CAS 53525-55-6), with molecular formula C5H7N3O and molecular weight 125.06 g/mol. IUPAC: N-methyl-1H-imidazole-5-carboxamide.
Chemical Property Profile of N-Methyl-1H-imidazole-4-carboxamide
Property Insights of N-Methyl-1H-imidazole-4-carboxamide
The XLogP value of -0.3 indicates that N-Methyl-1H-imidazole-4-carboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.8 Ų, N-Methyl-1H-imidazole-4-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Methyl-1H-imidazole-4-carboxamide has 2 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 N-Methyl-1H-imidazole-4-carboxamide?
The CAS number of N-Methyl-1H-imidazole-4-carboxamide is 53525-55-6.
What is the molecular formula of N-Methyl-1H-imidazole-4-carboxamide?
The molecular formula of N-Methyl-1H-imidazole-4-carboxamide is C5H7N3O.
What is the molecular weight of N-Methyl-1H-imidazole-4-carboxamide?
The molecular weight of N-Methyl-1H-imidazole-4-carboxamide is 125.06 g/mol.
Where can I buy N-Methyl-1H-imidazole-4-carboxamide?
You can request a quote for N-Methyl-1H-imidazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyl-1H-imidazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-Methyl-1H-imidazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.