3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one

C18H14N4O — CID 137148027

IUPAC3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one
SMILESCc1ccc2nc(-c3cc(-c4ccncc4)c[nH]c3=O)[nH]c2c1
InChIInChI=1S/C18H14N4O/c1-11-2-3-15-16(8-11)22-17(21-15)14-9-13(10-20-18(14)23)12-4-6-19-7-5-12/h2-10H,1H3,(H,20,23)(H,21,22)
InChIKeyHRDIERHTKPPIKL-UHFFFAOYSA-N
MW302.34 g/mol
LogP3.29
Rot. Bonds2

About 3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one

3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one (PubChem CID 137148027) has the molecular formula C18H14N4O and a molecular weight of 302.34 g/mol. Its IUPAC name is 3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one
PubChem CID137148027
Molecular FormulaC18H14N4O
Molecular Weight302.34 g/mol
Exact Mass302.12
IUPAC Name3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one
SMILESCc1ccc2nc(-c3cc(-c4ccncc4)c[nH]c3=O)[nH]c2c1
InChIInChI=1S/C18H14N4O/c1-11-2-3-15-16(8-11)22-17(21-15)14-9-13(10-20-18(14)23)12-4-6-19-7-5-12/h2-10H,1H3,(H,20,23)(H,21,22)
InChIKeyHRDIERHTKPPIKL-UHFFFAOYSA-N
XLogP3.29
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dipyridin-4-yl-1H-pyridin-2-one
CID 46316548
6-methyl-2-[4-(6-methyl-1H-benzimidazol-2-yl)phenyl]-1H-benzimidazole
CID 20689909
ethane;3-[6-(6-methyl-2,6-diazaspiro[3.3]heptan-2-yl)-1H-benzimidazol-2-yl]-5-pyridin-3-yl-1H-pyridin-2-one
CID 143458278
5-[4-(hydroxymethyl)phenyl]-3-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-pyridin-2-one
CID 137146396
6-methyl-2-pyrimidin-5-yl-1H-benzimidazole
CID 102922101
5-methyl-3-(6-methyl-1H-benzimidazol-2-yl)thiophen-2-amine
CID 55250119
methane;4-(6-methyl-1H-benzimidazol-2-yl)aniline
CID 159476815
4-(6-methyl-1H-benzimidazol-2-yl)fluoren-9-one
CID 67359622
6-methyl-2-[6-(6-methyl-1H-benzimidazol-2-yl)-2-pyridinyl]-1H-benzimidazole
CID 3532439
4-methyl-N-(2-pyridin-4-yl-3H-benzimidazol-5-yl)benzenesulfonamide
CID 4192275
6-methyl-2-(4-methylsulfonylphenyl)-1H-benzimidazole
CID 60979057
3-hydroxy-5-pyridin-4-yl-1H-pyridin-2-one
CID 20517045

Frequently Asked Questions

What is the IUPAC name of 3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one?
The IUPAC name of 3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one (CID 137148027) is 3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one.
What is the SMILES notation for 3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one?
The canonical SMILES for 3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one is Cc1ccc2nc(-c3cc(-c4ccncc4)c[nH]c3=O)[nH]c2c1.
What is the InChIKey of 3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one?
The InChIKey is HRDIERHTKPPIKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O/c1-11-2-3-15-16(8-11)22-17(21-15)14-9-13(10-20-18(14)23)12-4-6-19-7-5-12/h2-10H,1H3,(H,20,23)(H,21,22).
What are the key properties of 3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one?
3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one has a molecular weight of 302.34 g/mol, XLogP of 3.29, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methyl-1H-benzimidazol-2-yl)-5-pyridin-4-yl-1H-pyridin-2-one is sourced from PubChem (CID 137148027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).