3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol

C14H13N3O — CID 137004995

IUPAC3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol
SMILESCc1cc(O)ccc1-c1nc2ncccc2n1C
InChIInChI=1S/C14H13N3O/c1-9-8-10(18)5-6-11(9)14-16-13-12(17(14)2)4-3-7-15-13/h3-8,18H,1-2H3
InChIKeyXXESUAHPCJDDKI-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.65
Rot. Bonds1

About 3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol

3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol (PubChem CID 137004995) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is 3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol.

Molecular Properties

Compound Name3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol
PubChem CID137004995
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC Name3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol
SMILESCc1cc(O)ccc1-c1nc2ncccc2n1C
InChIInChI=1S/C14H13N3O/c1-9-8-10(18)5-6-11(9)14-16-13-12(17(14)2)4-3-7-15-13/h3-8,18H,1-2H3
InChIKeyXXESUAHPCJDDKI-UHFFFAOYSA-N
XLogP2.65
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-methylimidazo[4,5-b]pyridin-2-yl)benzene-1,4-diol
CID 136756257
3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol
CID 136750908
4-(1-methylimidazo[4,5-b]pyridin-2-yl)aniline
CID 114113127
5-(1-methylimidazo[4,5-b]pyridin-2-yl)benzene-1,3-dicarbonitrile
CID 167882024
4-(1-ethylbenzimidazol-2-yl)-3-methylphenol
CID 136750847
N'-[2-(diethylamino)ethyl]-N,N-diethyl-N'-[2-(1-methylimidazo[4,5-b]pyridin-2-yl)phenyl]ethane-1,2-diamine
CID 18621426
4-methyl-5-(1-methylimidazo[4,5-b]pyridin-2-yl)-1,3-thiazol-2-amine
CID 114113082
4-[4-(4-hydroxy-2-methylphenyl)furan-3-yl]-3-methylphenol
CID 71625173
N'-[2-(diethylamino)ethyl]-N,N-diethyl-N'-[4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenyl]ethane-1,2-diamine
CID 21260450
1-methyl-2-(5-methylsulfonylfuran-2-yl)imidazo[4,5-b]pyridine
CID 167946530
2-(2,4-dichlorophenyl)-1-hydroxyimidazo[4,5-b]pyridine
CID 1486133
N'-hydroxy-1-methylimidazo[4,5-b]pyridine-2-carboximidamide
CID 135456631

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol?
The IUPAC name of 3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol (CID 137004995) is 3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol.
What is the SMILES notation for 3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol?
The canonical SMILES for 3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol is Cc1cc(O)ccc1-c1nc2ncccc2n1C.
What is the InChIKey of 3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol?
The InChIKey is XXESUAHPCJDDKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c1-9-8-10(18)5-6-11(9)14-16-13-12(17(14)2)4-3-7-15-13/h3-8,18H,1-2H3.
What are the key properties of 3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol?
3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol has a molecular weight of 239.28 g/mol, XLogP of 2.65, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol is sourced from PubChem (CID 137004995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).