6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide

C18H12FN5O — CID 146315904

IUPAC6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide
SMILESNC(=O)c1ccc(-n2cnc3ccc(-c4ccncc4)c(F)c32)nc1
InChIInChI=1S/C18H12FN5O/c19-16-13(11-5-7-21-8-6-11)2-3-14-17(16)24(10-23-14)15-4-1-12(9-22-15)18(20)25/h1-10H,(H2,20,25)
InChIKeyNZMORJNHULLERW-UHFFFAOYSA-N
MW333.33 g/mol
LogP2.72
Rot. Bonds3

About 6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide

6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide (PubChem CID 146315904) has the molecular formula C18H12FN5O and a molecular weight of 333.33 g/mol. Its IUPAC name is 6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide
PubChem CID146315904
Molecular FormulaC18H12FN5O
Molecular Weight333.33 g/mol
Exact Mass333.10
IUPAC Name6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide
SMILESNC(=O)c1ccc(-n2cnc3ccc(-c4ccncc4)c(F)c32)nc1
InChIInChI=1S/C18H12FN5O/c19-16-13(11-5-7-21-8-6-11)2-3-14-17(16)24(10-23-14)15-4-1-12(9-22-15)18(20)25/h1-10H,(H2,20,25)
InChIKeyNZMORJNHULLERW-UHFFFAOYSA-N
XLogP2.72
TPSA86.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.33
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

AR-H047108
CID 9864291
(3R)-1-(2-(1-((4-fluorophenyl)methyl)-1H-indol-2-yl)-3-methylimidazo(1,2-a)pyridine-7-carbonyl)piperidin-3-amine
CID 138578805
(2-Amino-6-(2,6-Difluoro-Benzoyl)-Imidazo(1,2-a)Pyridin-3-Yl)-Phenyl-Methanone
CID 5289179
6H-Dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one, 11-ethyl-5,11-dihydro-5-methyl-2-(1H-pyrrolo(2,3-c)pyridin-3-yl)-
CID 466848
6H-Dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one, 11-ethyl-5,11-dihydro-2-(1H-indol-3-yl)-5-methyl-
CID 466843
6-(4-fluorophenyl)-N-[2-[methyl(propan-2-yl)amino]-3H-benzimidazol-5-yl]pyridine-3-carboxamide
CID 9978508
N-(4-{5-[3-(Acetylamino)phenyl]-2-(2-Aminopyridin-3-Yl)-3h-Imidazo[4,5-B]pyridin-3-Yl}benzyl)-3-Fluorobenzamide
CID 56965952
1-(4-benzoylpiperazin-1-yl)-2-(4-fluoro-7-imidazol-1-yl-1H-pyrrolo[2,3-c]pyridin-3-yl)ethane-1,2-dione
CID 15958791
N-(3-fluorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide
CID 44137900
N-(2,5-difluorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide
CID 44137901
N-(6-fluoro-2-pyridinyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide
CID 67140847
N-phenyl-6-(pyrid-2-yl)imidazo[1,2-a]pyridine-2-carboxamide
CID 68779277

Frequently Asked Questions

What is the IUPAC name of 6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide?
The IUPAC name of 6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide (CID 146315904) is 6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide is NC(=O)c1ccc(-n2cnc3ccc(-c4ccncc4)c(F)c32)nc1.
What is the InChIKey of 6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide?
The InChIKey is NZMORJNHULLERW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12FN5O/c19-16-13(11-5-7-21-8-6-11)2-3-14-17(16)24(10-23-14)15-4-1-12(9-22-15)18(20)25/h1-10H,(H2,20,25).
What are the key properties of 6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide?
6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide has a molecular weight of 333.33 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(7-fluoro-6-pyridin-4-ylbenzimidazol-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 146315904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).