3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide

C21H15F2N5O — CID 68867369

IUPAC3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide
SMILESNC(=O)c1nc(-c2[nH]c(-c3c(F)cccc3F)nc2-c2ccccc2)ccc1N
InChIInChI=1S/C21H15F2N5O/c22-12-7-4-8-13(23)16(12)21-27-17(11-5-2-1-3-6-11)19(28-21)15-10-9-14(24)18(26-15)20(25)29/h1-10H,24H2,(H2,25,29)(H,27,28)
InChIKeyWASFKKCMNNJWSJ-UHFFFAOYSA-N
MW391.38 g/mol
LogP3.77
Rot. Bonds4

About 3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide

3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide (PubChem CID 68867369) has the molecular formula C21H15F2N5O and a molecular weight of 391.38 g/mol. Its IUPAC name is 3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide
PubChem CID68867369
Molecular FormulaC21H15F2N5O
Molecular Weight391.38 g/mol
Exact Mass391.12
IUPAC Name3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide
SMILESNC(=O)c1nc(-c2[nH]c(-c3c(F)cccc3F)nc2-c2ccccc2)ccc1N
InChIInChI=1S/C21H15F2N5O/c22-12-7-4-8-13(23)16(12)21-27-17(11-5-2-1-3-6-11)19(28-21)15-10-9-14(24)18(26-15)20(25)29/h1-10H,24H2,(H2,25,29)(H,27,28)
InChIKeyWASFKKCMNNJWSJ-UHFFFAOYSA-N
XLogP3.77
TPSA110.68 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.38
LogP ≤ 53.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

6-[2-(2,6-dichlorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2,3-diamine
CID 68866740
3-butyl-5-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]imidazo[4,5-b]pyridin-2-amine;methanesulfonic acid
CID 87616607
5-[2-(2-chloro-6-fluorophenyl)-4-phenyl-1H-imidazol-5-yl]-3-propan-2-ylsulfonylimidazo[4,5-b]pyridin-2-amine
CID 87616844
5-[2-[2-fluoro-6-(trifluoromethyl)phenyl]-4-phenyl-1H-imidazol-5-yl]-3-propan-2-ylsulfonylimidazo[4,5-b]pyridin-2-amine
CID 87616211
5-[2-(2-chloro-6-fluorophenyl)-4-phenyl-1H-imidazol-5-yl]-3-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine
CID 11705579
2-amino-6-[2-(2,6-difluorophenyl)-5-phenyl-1H-imidazol-4-yl]-N,N-dimethylbenzimidazole-1-sulfonamide;methanesulfonic acid
CID 11377433
2-(2-chloro-6-fluorophenyl)-4-(6-phenyl-3-pyridinyl)-1H-imidazole-5-carboxylic acid
CID 70833482
3-fluoro-6-(2-fluorophenyl)pyridine-2-carboxamide
CID 141313385
4-[2-(2,6-difluorophenyl)-4-(3-methylphenyl)-1H-imidazol-5-yl]pyridine
CID 71625692
2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide
CID 59587669
4-[5-bromo-2-(2-chloro-6-fluorophenyl)-1H-imidazol-4-yl]benzoic acid
CID 69189659
2-(2-fluoro-6-phosphanylphenyl)-5-phenyl-1,3-oxazole-4-carboxamide
CID 143993495

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide?
The IUPAC name of 3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide (CID 68867369) is 3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide is NC(=O)c1nc(-c2[nH]c(-c3c(F)cccc3F)nc2-c2ccccc2)ccc1N.
What is the InChIKey of 3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide?
The InChIKey is WASFKKCMNNJWSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15F2N5O/c22-12-7-4-8-13(23)16(12)21-27-17(11-5-2-1-3-6-11)19(28-21)15-10-9-14(24)18(26-15)20(25)29/h1-10H,24H2,(H2,25,29)(H,27,28).
What are the key properties of 3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide?
3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide has a molecular weight of 391.38 g/mol, XLogP of 3.77, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-[2-(2,6-difluorophenyl)-4-phenyl-1H-imidazol-5-yl]pyridine-2-carboxamide is sourced from PubChem (CID 68867369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).