1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide

C21H15FN4O2 — CID 91955106

IUPAC1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide
SMILESO=C(Nc1ccc(-c2cnc[nH]2)cc1)c1ccc(=O)n(-c2ccc(F)cc2)c1
InChIInChI=1S/C21H15FN4O2/c22-16-4-8-18(9-5-16)26-12-15(3-10-20(26)27)21(28)25-17-6-1-14(2-7-17)19-11-23-13-24-19/h1-13H,(H,23,24)(H,25,28)
InChIKeyDUDAXBCBMFLIKP-UHFFFAOYSA-N
MW374.38 g/mol
LogP3.62
Rot. Bonds4

About 1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide

1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide (PubChem CID 91955106) has the molecular formula C21H15FN4O2 and a molecular weight of 374.38 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide
PubChem CID91955106
Molecular FormulaC21H15FN4O2
Molecular Weight374.38 g/mol
Exact Mass374.12
IUPAC Name1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide
SMILESO=C(Nc1ccc(-c2cnc[nH]2)cc1)c1ccc(=O)n(-c2ccc(F)cc2)c1
InChIInChI=1S/C21H15FN4O2/c22-16-4-8-18(9-5-16)26-12-15(3-10-20(26)27)21(28)25-17-6-1-14(2-7-17)19-11-23-13-24-19/h1-13H,(H,23,24)(H,25,28)
InChIKeyDUDAXBCBMFLIKP-UHFFFAOYSA-N
XLogP3.62
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.38
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1,3-dioxoisoindol-2-yl)-N-(4-fluorophenyl)benzamide
CID 1068099
3-formyl-N-[4-(1H-imidazol-5-yl)phenyl]benzamide
CID 90105435
N'-(4-fluorophenyl)-6-oxo-1-[4-(trifluoromethyl)phenyl]pyridine-3-carbohydrazide
CID 118039692
2-[5-[(4-fluorophenyl)carbamoyl]-2-oxo-1-pyridinyl]acetic acid
CID 110082545
N-[4-(1H-imidazol-5-yl)phenyl]-2-iodobenzamide
CID 60666058
4-(1H-imidazol-5-yl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
CID 166382068
N-[4-(1H-imidazol-5-yl)phenyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 60666303
N-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide
CID 26843818
6-chloro-N-[4-(1H-imidazol-5-yl)phenyl]pyridine-2-carboxamide
CID 62232925
4-fluoro-N-(4-pyrrol-1-ylphenyl)benzamide
CID 2768248
4-(4-fluorophenyl)-N-pyridin-4-ylbenzamide
CID 135137810
N-[4-(1H-imidazol-5-yl)phenyl]but-2-enamide
CID 78997234

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide (CID 91955106) is 1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide is O=C(Nc1ccc(-c2cnc[nH]2)cc1)c1ccc(=O)n(-c2ccc(F)cc2)c1.
What is the InChIKey of 1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide?
The InChIKey is DUDAXBCBMFLIKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15FN4O2/c22-16-4-8-18(9-5-16)26-12-15(3-10-20(26)27)21(28)25-17-6-1-14(2-7-17)19-11-23-13-24-19/h1-13H,(H,23,24)(H,25,28).
What are the key properties of 1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide?
1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide has a molecular weight of 374.38 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 91955106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).