N-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide

C18H16F2N4O — CID 71717116

IUPACN-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide
SMILESCc1nc(NC(=O)c2nc(C)n(-c3ccc(F)cc3)c2C)ccc1F
InChIInChI=1S/C18H16F2N4O/c1-10-15(20)8-9-16(21-10)23-18(25)17-11(2)24(12(3)22-17)14-6-4-13(19)5-7-14/h4-9H,1-3H3,(H,21,23,25)
InChIKeyYZKJBYRDKXPMTG-UHFFFAOYSA-N
MW342.35 g/mol
LogP3.72
Rot. Bonds3

About N-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide

N-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide (PubChem CID 71717116) has the molecular formula C18H16F2N4O and a molecular weight of 342.35 g/mol. Its IUPAC name is N-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide
PubChem CID71717116
Molecular FormulaC18H16F2N4O
Molecular Weight342.35 g/mol
Exact Mass342.13
IUPAC NameN-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide
SMILESCc1nc(NC(=O)c2nc(C)n(-c3ccc(F)cc3)c2C)ccc1F
InChIInChI=1S/C18H16F2N4O/c1-10-15(20)8-9-16(21-10)23-18(25)17-11(2)24(12(3)22-17)14-6-4-13(19)5-7-14/h4-9H,1-3H3,(H,21,23,25)
InChIKeyYZKJBYRDKXPMTG-UHFFFAOYSA-N
XLogP3.72
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.35
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-fluorophenyl)-2,5-dimethyl-N-(6-methylpyridin-2-yl)-1H-imidazole-4-carboxamide
CID 71580330
N-(2-chloropyrimidin-4-yl)-2,5-dimethyl-1-phenyl-1H-imidazole-4-carboxamide
CID 71580550
2-ethyl-9-(2-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
CID 7599528
1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one
CID 15076567
N-[4-[7-(3-fluorophenyl)-1,3-dimethyl-2,6-dioxopurin-8-yl]phenyl]acetamide
CID 52920521
1-N-[(2R)-butan-2-yl]-7-N-(3,4,5-trifluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide
CID 137452700
2-Methyl-imidazo[1,2-a]pyridine-3-carboxylic acid (6-methyl-pyridin-2-yl)-amide
CID 655070
2-cyclohexyl-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
CID 5310029
9-(4-fluorophenyl)-2-(2-methylpropyl)-8-oxo-7H-purine-6-carboxamide
CID 5310314
N-[2-(3,4-difluoroanilino)-2-oxoethyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 17393643
N-[1-[2-(4-fluoroanilino)pyrimidin-4-yl]pyrrolidin-3-yl]-3-methylimidazole-4-carboxamide
CID 44525928
2,5-dimethyl-1-phenyl-N-(2-(trifluoromethyl)phenyl)-1H-imidazole-4-carboxamide
CID 53322288

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide?
The IUPAC name of N-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide (CID 71717116) is N-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide.
What is the SMILES notation for N-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide?
The canonical SMILES for N-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide is Cc1nc(NC(=O)c2nc(C)n(-c3ccc(F)cc3)c2C)ccc1F.
What is the InChIKey of N-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide?
The InChIKey is YZKJBYRDKXPMTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16F2N4O/c1-10-15(20)8-9-16(21-10)23-18(25)17-11(2)24(12(3)22-17)14-6-4-13(19)5-7-14/h4-9H,1-3H3,(H,21,23,25).
What are the key properties of N-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide?
N-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide has a molecular weight of 342.35 g/mol, XLogP of 3.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide is sourced from PubChem (CID 71717116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).