6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide

C16H11N5O — CID 174726187

IUPAC6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide
SMILESN#Cc1ccc(-c2ccc(C(=O)Nn3ccnc3)cn2)cc1
InChIInChI=1S/C16H11N5O/c17-9-12-1-3-13(4-2-12)15-6-5-14(10-19-15)16(22)20-21-8-7-18-11-21/h1-8,10-11H,(H,20,22)
InChIKeyVKGZZDXZGVDRGI-UHFFFAOYSA-N
MW289.30 g/mol
LogP2.20
Rot. Bonds3

About 6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide

6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide (PubChem CID 174726187) has the molecular formula C16H11N5O and a molecular weight of 289.30 g/mol. Its IUPAC name is 6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide
PubChem CID174726187
Molecular FormulaC16H11N5O
Molecular Weight289.30 g/mol
Exact Mass289.10
IUPAC Name6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide
SMILESN#Cc1ccc(-c2ccc(C(=O)Nn3ccnc3)cn2)cc1
InChIInChI=1S/C16H11N5O/c17-9-12-1-3-13(4-2-12)15-6-5-14(10-19-15)16(22)20-21-8-7-18-11-21/h1-8,10-11H,(H,20,22)
InChIKeyVKGZZDXZGVDRGI-UHFFFAOYSA-N
XLogP2.20
TPSA83.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.30
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(5-imidazol-1-yl-2-pyridinyl)benzonitrile
CID 118978613
6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile
CID 11849612
5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile
CID 67751358
2-[6-(4-cyanophenyl)-3-pyridinyl]hexa-2,4-dienoic acid
CID 154221794
6-[1-(4-cyanophenyl)pyrazol-4-yl]-N-(2-methoxyethyl)pyridine-3-carboxamide
CID 4268648
benzonitrile;4-(imidazol-1-ylamino)benzonitrile
CID 158279093
4-(1-imidazol-1-ylethenyl)benzonitrile
CID 11819989
N-[4-(4-cyanophenoxy)-1-imidazol-1-ylbutan-2-yl]-4-iodobenzamide
CID 10163183
N-(4-cyanophenyl)-2-imidazol-1-ylpropanamide
CID 43176830
4-(4-cyanophenyl)-N-methylbenzamide
CID 130318851
N-phenyl-6-pyridin-4-ylpyridine-3-carboxamide
CID 174640985
4-[4-[5-(4-methylpiperazine-1-carbonyl)-2-pyridinyl]pyrazol-1-yl]benzonitrile
CID 3407693

Frequently Asked Questions

What is the IUPAC name of 6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide?
The IUPAC name of 6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide (CID 174726187) is 6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide.
What is the SMILES notation for 6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide?
The canonical SMILES for 6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide is N#Cc1ccc(-c2ccc(C(=O)Nn3ccnc3)cn2)cc1.
What is the InChIKey of 6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide?
The InChIKey is VKGZZDXZGVDRGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N5O/c17-9-12-1-3-13(4-2-12)15-6-5-14(10-19-15)16(22)20-21-8-7-18-11-21/h1-8,10-11H,(H,20,22).
What are the key properties of 6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide?
6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide has a molecular weight of 289.30 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-cyanophenyl)-N-imidazol-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 174726187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).