3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol

C16H16ClN3O2 — CID 94757541

IUPAC3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol
SMILESCOc1ccccc1-c1nc2cc(Cl)cnc2n1CCCO
InChIInChI=1S/C16H16ClN3O2/c1-22-14-6-3-2-5-12(14)15-19-13-9-11(17)10-18-16(13)20(15)7-4-8-21/h2-3,5-6,9-10,21H,4,7-8H2,1H3
InChIKeyYVFZMLMIUBSGMC-UHFFFAOYSA-N
MW317.78 g/mol
LogP3.14
Rot. Bonds5

About 3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol

3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol (PubChem CID 94757541) has the molecular formula C16H16ClN3O2 and a molecular weight of 317.78 g/mol. Its IUPAC name is 3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol.

Molecular Properties

Compound Name3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol
PubChem CID94757541
Molecular FormulaC16H16ClN3O2
Molecular Weight317.78 g/mol
Exact Mass317.09
IUPAC Name3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol
SMILESCOc1ccccc1-c1nc2cc(Cl)cnc2n1CCCO
InChIInChI=1S/C16H16ClN3O2/c1-22-14-6-3-2-5-12(14)15-19-13-9-11(17)10-18-16(13)20(15)7-4-8-21/h2-3,5-6,9-10,21H,4,7-8H2,1H3
InChIKeyYVFZMLMIUBSGMC-UHFFFAOYSA-N
XLogP3.14
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.78
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol with MolForge

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Related Compounds

[1-[(2-Methoxyphenyl)methyl]benzimidazol-2-yl]methanol
CID 755585
3-Chloro-2-(4-methoxyphenyl)imidazo[1,2-a]pyridine
CID 1104473
2-(3-Chloro-2-methoxyphenyl)imidazo[1,2-a]pyridine
CID 2725744
5-[(2-Methoxyphenyl)methyl]-2-phenyl-imidazo[4,5-c]pyridine
CID 10403427
7-[2-Chloro-4-(difluoromethoxy)phenyl]-3-(1-cyclobutylethyl)-2-ethylimidazo[4,5-b]pyridine
CID 10222981
2-Ethyl-7-(4-methoxy-2,5-dimethylphenyl)-3-pentan-2-ylimidazo[4,5-b]pyridine
CID 44458897
2-Ethyl-7-(4-methoxy-2-methylphenyl)-3-pentan-2-ylimidazo[4,5-b]pyridine
CID 44458969
6-chloro-2-(4-chloro-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine
CID 137650941
2-(3-Chloro-2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridine
CID 2725743
6-chloro-N-(2-methoxyethyl)-2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-amine
CID 3201357
(8-Benzyloxy-2-methyl-imidazo[1,2-a]pyridin-3-yl)-methanol
CID 9860166
2-(2-Butoxy-phenyl)-3H-imidazo[4,5-b]pyridine
CID 10423102

Frequently Asked Questions

What is the IUPAC name of 3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol?
The IUPAC name of 3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol (CID 94757541) is 3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol.
What is the SMILES notation for 3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol?
The canonical SMILES for 3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol is COc1ccccc1-c1nc2cc(Cl)cnc2n1CCCO.
What is the InChIKey of 3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol?
The InChIKey is YVFZMLMIUBSGMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClN3O2/c1-22-14-6-3-2-5-12(14)15-19-13-9-11(17)10-18-16(13)20(15)7-4-8-21/h2-3,5-6,9-10,21H,4,7-8H2,1H3.
What are the key properties of 3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol?
3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol has a molecular weight of 317.78 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol is sourced from PubChem (CID 94757541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).