N-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide

C14H13N5O — CID 18152609

IUPACN-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide
SMILESCn1ccc(NC(=O)c2cncn2-c2ccccc2)n1
InChIInChI=1S/C14H13N5O/c1-18-8-7-13(17-18)16-14(20)12-9-15-10-19(12)11-5-3-2-4-6-11/h2-10H,1H3,(H,16,17,20)
InChIKeyNNQHEDZUGGPZSI-UHFFFAOYSA-N
MW267.29 g/mol
LogP1.86
Rot. Bonds3

About N-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide

N-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide (PubChem CID 18152609) has the molecular formula C14H13N5O and a molecular weight of 267.29 g/mol. Its IUPAC name is N-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide.

Molecular Properties

Compound NameN-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide
PubChem CID18152609
Molecular FormulaC14H13N5O
Molecular Weight267.29 g/mol
Exact Mass267.11
IUPAC NameN-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide
SMILESCn1ccc(NC(=O)c2cncn2-c2ccccc2)n1
InChIInChI=1S/C14H13N5O/c1-18-8-7-13(17-18)16-14(20)12-9-15-10-19(12)11-5-3-2-4-6-11/h2-10H,1H3,(H,16,17,20)
InChIKeyNNQHEDZUGGPZSI-UHFFFAOYSA-N
XLogP1.86
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide?
The IUPAC name of N-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide (CID 18152609) is N-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide.
What is the SMILES notation for N-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide?
The canonical SMILES for N-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide is Cn1ccc(NC(=O)c2cncn2-c2ccccc2)n1.
What is the InChIKey of N-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide?
The InChIKey is NNQHEDZUGGPZSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O/c1-18-8-7-13(17-18)16-14(20)12-9-15-10-19(12)11-5-3-2-4-6-11/h2-10H,1H3,(H,16,17,20).
What are the key properties of N-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide?
N-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpyrazol-3-yl)-3-phenylimidazole-4-carboxamide is sourced from PubChem (CID 18152609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).