N-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide

C15H12N4O — CID 110466598

IUPACN-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide
SMILESO=C(Nc1ccc(-c2ccccn2)cc1)c1ncc[nH]1
InChIInChI=1S/C15H12N4O/c20-15(14-17-9-10-18-14)19-12-6-4-11(5-7-12)13-3-1-2-8-16-13/h1-10H,(H,17,18)(H,19,20)
InChIKeyDTTBFSYHBDBIAJ-UHFFFAOYSA-N
MW264.29 g/mol
LogP2.72
Rot. Bonds3

About N-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide

N-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide (PubChem CID 110466598) has the molecular formula C15H12N4O and a molecular weight of 264.29 g/mol. Its IUPAC name is N-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide.

Molecular Properties

Compound NameN-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide
PubChem CID110466598
Molecular FormulaC15H12N4O
Molecular Weight264.29 g/mol
Exact Mass264.10
IUPAC NameN-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide
SMILESO=C(Nc1ccc(-c2ccccn2)cc1)c1ncc[nH]1
InChIInChI=1S/C15H12N4O/c20-15(14-17-9-10-18-14)19-12-6-4-11(5-7-12)13-3-1-2-8-16-13/h1-10H,(H,17,18)(H,19,20)
InChIKeyDTTBFSYHBDBIAJ-UHFFFAOYSA-N
XLogP2.72
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide?
The IUPAC name of N-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide (CID 110466598) is N-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide.
What is the SMILES notation for N-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide?
The canonical SMILES for N-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide is O=C(Nc1ccc(-c2ccccn2)cc1)c1ncc[nH]1.
What is the InChIKey of N-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide?
The InChIKey is DTTBFSYHBDBIAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O/c20-15(14-17-9-10-18-14)19-12-6-4-11(5-7-12)13-3-1-2-8-16-13/h1-10H,(H,17,18)(H,19,20).
What are the key properties of N-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide?
N-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide has a molecular weight of 264.29 g/mol, XLogP of 2.72, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-pyridin-2-ylphenyl)-1H-imidazole-2-carboxamide is sourced from PubChem (CID 110466598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).