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

C13H10ClN3O — CID 167785280

IUPAC6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol
SMILESCc1ccc2[nH]c(-c3ccc(O)cn3)nc2c1Cl
InChIInChI=1S/C13H10ClN3O/c1-7-2-4-9-12(11(7)14)17-13(16-9)10-5-3-8(18)6-15-10/h2-6,18H,1H3,(H,16,17)
InChIKeyBSTYAJBKWYYMRC-UHFFFAOYSA-N
MW259.70 g/mol
LogP3.29
Rot. Bonds1

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

6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol (PubChem CID 167785280) has the molecular formula C13H10ClN3O and a molecular weight of 259.70 g/mol. Its IUPAC name is 6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol.

Molecular Properties

Compound Name6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol
PubChem CID167785280
Molecular FormulaC13H10ClN3O
Molecular Weight259.70 g/mol
Exact Mass259.05
IUPAC Name6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol
SMILESCc1ccc2[nH]c(-c3ccc(O)cn3)nc2c1Cl
InChIInChI=1S/C13H10ClN3O/c1-7-2-4-9-12(11(7)14)17-13(16-9)10-5-3-8(18)6-15-10/h2-6,18H,1H3,(H,16,17)
InChIKeyBSTYAJBKWYYMRC-UHFFFAOYSA-N
XLogP3.29
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.70
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-4-fluoro-2-(5-fluoro-2-pyridinyl)-1H-benzimidazole
CID 114271734
8-chloro-7-methylquinolin-3-ol
CID 130495707
6-(5-hydroxy-2-pyridinyl)pyridin-3-ol
CID 135830900
6-(4-methyl-1H-benzimidazol-2-yl)pyridine-3-carbonitrile
CID 64722293
6-(4,6-dimethyl-1H-benzimidazol-2-yl)pyridin-3-amine
CID 82946936
6-(2,3,6-trichlorophenyl)pyridin-3-ol
CID 133092618
N-[6-(5-chloro-4-methyl-6-oxo-1H-pyrimidin-2-yl)-3-pyridinyl]acetamide
CID 135909405
2-(5-fluoro-2-pyridinyl)-7-methyl-1H-imidazo[4,5-b]pyridine
CID 104639110
2-(5-fluoro-2-pyridinyl)-6-methyl-1H-benzimidazole
CID 104639104
4-bromo-2-[5-(3-chloro-2-pyridinyl)-2-pyridinyl]-6-methyl-1H-benzimidazole
CID 143269331
4,5-dimethyl-2-thiophen-3-yl-1H-benzimidazole
CID 2799872
2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine
CID 104639107

Frequently Asked Questions

What is the IUPAC name of 6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol?
The IUPAC name of 6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol (CID 167785280) is 6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol.
What is the SMILES notation for 6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol?
The canonical SMILES for 6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol is Cc1ccc2[nH]c(-c3ccc(O)cn3)nc2c1Cl.
What is the InChIKey of 6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol?
The InChIKey is BSTYAJBKWYYMRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClN3O/c1-7-2-4-9-12(11(7)14)17-13(16-9)10-5-3-8(18)6-15-10/h2-6,18H,1H3,(H,16,17).
What are the key properties of 6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol?
6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol has a molecular weight of 259.70 g/mol, XLogP of 3.29, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chloro-5-methyl-1H-benzimidazol-2-yl)pyridin-3-ol is sourced from PubChem (CID 167785280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).