2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol

C17H19N3O2 — CID 82150790

IUPAC2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol
SMILESCc1ccc(OCc2nc3cc(C)cnc3n2CCO)cc1
InChIInChI=1S/C17H19N3O2/c1-12-3-5-14(6-4-12)22-11-16-19-15-9-13(2)10-18-17(15)20(16)7-8-21/h3-6,9-10,21H,7-8,11H2,1-2H3
InChIKeyWTCQFEKWCJXDMM-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.62
Rot. Bonds5

About 2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol

2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol (PubChem CID 82150790) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is 2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol.

Molecular Properties

Compound Name2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol
PubChem CID82150790
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Name2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol
SMILESCc1ccc(OCc2nc3cc(C)cnc3n2CCO)cc1
InChIInChI=1S/C17H19N3O2/c1-12-3-5-14(6-4-12)22-11-16-19-15-9-13(2)10-18-17(15)20(16)7-8-21/h3-6,9-10,21H,7-8,11H2,1-2H3
InChIKeyWTCQFEKWCJXDMM-UHFFFAOYSA-N
XLogP2.62
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[6-chloro-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanamine
CID 93209820
3-(2-ethyl-6-methylimidazo[4,5-b]pyridin-3-yl)propan-1-ol
CID 82150914
2-[6-chloro-2-(methoxymethyl)imidazo[4,5-b]pyridin-3-yl]ethanol
CID 82150825
2-[2-(3,4-dimethylphenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]ethanol
CID 82150776
2-[6-methyl-2-(trifluoromethyl)imidazo[4,5-b]pyridin-3-yl]ethanol
CID 82150794
2-[5-chloro-2-[(4-chlorophenoxy)methyl]benzimidazol-1-yl]ethanol
CID 46308197
3-[2-[(4-methoxyphenyl)methyl]-6-methylimidazo[4,5-b]pyridin-3-yl]propan-1-amine
CID 93209647
3-[6-methyl-2-(3-phenoxypropyl)imidazo[4,5-b]pyridin-3-yl]propan-1-amine
CID 145420127
3-[6-methyl-2-(2-phenoxyethyl)imidazo[4,5-b]pyridin-3-yl]propanenitrile
CID 94745988
3-(2-ethyl-6-methylimidazo[4,5-b]pyridin-3-yl)propanoic acid
CID 82061501
3-[2-[(4-chlorophenoxy)methyl]-5,6-dimethylbenzimidazol-1-yl]propan-1-ol
CID 21188655
2-[2-[(3-methoxyphenoxy)methyl]-5,6-dimethylbenzimidazol-1-yl]ethanol
CID 82149347

Frequently Asked Questions

What is the IUPAC name of 2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol?
The IUPAC name of 2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol (CID 82150790) is 2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol.
What is the SMILES notation for 2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol?
The canonical SMILES for 2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol is Cc1ccc(OCc2nc3cc(C)cnc3n2CCO)cc1.
What is the InChIKey of 2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol?
The InChIKey is WTCQFEKWCJXDMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-12-3-5-14(6-4-12)22-11-16-19-15-9-13(2)10-18-17(15)20(16)7-8-21/h3-6,9-10,21H,7-8,11H2,1-2H3.
What are the key properties of 2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol?
2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol has a molecular weight of 297.36 g/mol, XLogP of 2.62, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-methyl-2-[(4-methylphenoxy)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol is sourced from PubChem (CID 82150790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).