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

C16H17N3O — CID 136750908

IUPAC3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol
SMILESCCCn1c(-c2ccc(O)cc2C)nc2cccnc21
InChIInChI=1S/C16H17N3O/c1-3-9-19-15(13-7-6-12(20)10-11(13)2)18-14-5-4-8-17-16(14)19/h4-8,10,20H,3,9H2,1-2H3
InChIKeyIOYSNLZHKLYVBO-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.52
Rot. Bonds3

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

3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol (PubChem CID 136750908) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is 3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol.

Molecular Properties

Compound Name3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol
PubChem CID136750908
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol
SMILESCCCn1c(-c2ccc(O)cc2C)nc2cccnc21
InChIInChI=1S/C16H17N3O/c1-3-9-19-15(13-7-6-12(20)10-11(13)2)18-14-5-4-8-17-16(14)19/h4-8,10,20H,3,9H2,1-2H3
InChIKeyIOYSNLZHKLYVBO-UHFFFAOYSA-N
XLogP3.52
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-4-(1-propylimidazo[4,5-c]pyridin-2-yl)phenol
CID 136750904
3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol
CID 136789728
2-(3-ethylimidazo[4,5-b]pyridin-2-yl)-5-fluorophenol
CID 136789710
4-(1-ethylbenzimidazol-2-yl)-3-methylphenol
CID 136750847
3-(3-ethylimidazo[4,5-b]pyridin-2-yl)phenol
CID 63757136
2-ethyl-3-propylimidazo[4,5-b]pyridine
CID 20777190
3-methyl-4-(1-methylimidazo[4,5-b]pyridin-2-yl)phenol
CID 137004995
3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2,5,6-trifluorophenol
CID 63757477
3-chloro-4-(3-ethylimidazo[4,5-b]pyridin-2-yl)aniline
CID 55241902
3-(3-propylimidazo[4,5-b]pyridin-2-yl)-N-[(2,4,6-trimethylphenyl)methyl]benzamide
CID 53149051
3-ethyl-2-methylimidazo[4,5-b]pyridine
CID 23298284
N-(4-methylsulfanylphenyl)-3-(3-propylimidazo[4,5-b]pyridin-2-yl)benzamide
CID 53149025

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol?
The IUPAC name of 3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol (CID 136750908) is 3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol.
What is the SMILES notation for 3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol?
The canonical SMILES for 3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol is CCCn1c(-c2ccc(O)cc2C)nc2cccnc21.
What is the InChIKey of 3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol?
The InChIKey is IOYSNLZHKLYVBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-3-9-19-15(13-7-6-12(20)10-11(13)2)18-14-5-4-8-17-16(14)19/h4-8,10,20H,3,9H2,1-2H3.
What are the key properties of 3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol?
3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol has a molecular weight of 267.33 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol is sourced from PubChem (CID 136750908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).