3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide

C22H17FN4O — CID 166222014

IUPAC3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide
SMILESCc1ccc(-c2cccnc2)cc1NC(=O)c1cncn1-c1ccc(F)cc1
InChIInChI=1S/C22H17FN4O/c1-15-4-5-16(17-3-2-10-24-12-17)11-20(15)26-22(28)21-13-25-14-27(21)19-8-6-18(23)7-9-19/h2-14H,1H3,(H,26,28)
InChIKeyBKKOTRLJFRMDJX-UHFFFAOYSA-N
MW372.40 g/mol
LogP4.63
Rot. Bonds4

About 3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide

3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide (PubChem CID 166222014) has the molecular formula C22H17FN4O and a molecular weight of 372.40 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide
PubChem CID166222014
Molecular FormulaC22H17FN4O
Molecular Weight372.40 g/mol
Exact Mass372.14
IUPAC Name3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide
SMILESCc1ccc(-c2cccnc2)cc1NC(=O)c1cncn1-c1ccc(F)cc1
InChIInChI=1S/C22H17FN4O/c1-15-4-5-16(17-3-2-10-24-12-17)11-20(15)26-22(28)21-13-25-14-27(21)19-8-6-18(23)7-9-19/h2-14H,1H3,(H,26,28)
InChIKeyBKKOTRLJFRMDJX-UHFFFAOYSA-N
XLogP4.63
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.40
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-fluorophenyl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)imidazole-4-carboxamide
CID 18127545
1-(4-fluorophenyl)-N-(2-methylphenyl)-5-pyridin-3-ylpyrazole-3-carboxamide
CID 53067775
3-(4-fluorophenyl)imidazole-4-carbohydrazide
CID 5092120
1-methyl-N-(2-methyl-5-pyridin-3-ylphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-7-carboxamide
CID 166222006
N-(4-chloro-2-methylphenyl)-1-(4-fluorophenyl)-5-pyridin-3-ylpyrazole-3-carboxamide
CID 53067744
N-[3-[(3-fluorobenzoyl)amino]-4-methoxyphenyl]-3-(4-fluorophenyl)imidazole-4-carboxamide
CID 55725884
N-(4-fluoro-2-methylphenyl)-1-(4-fluorophenyl)-5-pyridin-3-yltriazole-4-carboxamide
CID 53125173
(2-methyl-5-pyridin-3-ylphenyl)hydrazine
CID 54381341
N-[5-(furan-2-yl)-2-methylphenyl]-2-hydroxy-5-pyridin-3-ylbenzamide
CID 70668755
3-(4-fluorophenyl)-N-[(1S)-1-pyridin-4-ylethyl]imidazole-4-carboxamide
CID 39949661
ethyl N-[[3-(4-fluorophenyl)imidazole-4-carbonyl]amino]carbamate
CID 43002854
3-[4-(3,5-dimethylphenyl)phenyl]-N-(2-fluoroethyl)imidazole-4-carboxamide
CID 46081295

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide?
The IUPAC name of 3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide (CID 166222014) is 3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide.
What is the SMILES notation for 3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide?
The canonical SMILES for 3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide is Cc1ccc(-c2cccnc2)cc1NC(=O)c1cncn1-c1ccc(F)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide?
The InChIKey is BKKOTRLJFRMDJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17FN4O/c1-15-4-5-16(17-3-2-10-24-12-17)11-20(15)26-22(28)21-13-25-14-27(21)19-8-6-18(23)7-9-19/h2-14H,1H3,(H,26,28).
What are the key properties of 3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide?
3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide has a molecular weight of 372.40 g/mol, XLogP of 4.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-N-(2-methyl-5-pyridin-3-ylphenyl)imidazole-4-carboxamide is sourced from PubChem (CID 166222014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).