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

C16H17N3O — CID 82829204

IUPAC2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol
SMILESCc1c(O)cccc1-c1nc2cccnc2n1C(C)C
InChIInChI=1S/C16H17N3O/c1-10(2)19-15(12-6-4-8-14(20)11(12)3)18-13-7-5-9-17-16(13)19/h4-10,20H,1-3H3
InChIKeyDBYBEGARPGWFQK-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.69
Rot. Bonds2

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

2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol (PubChem CID 82829204) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is 2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol.

Molecular Properties

Compound Name2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol
PubChem CID82829204
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol
SMILESCc1c(O)cccc1-c1nc2cccnc2n1C(C)C
InChIInChI=1S/C16H17N3O/c1-10(2)19-15(12-6-4-8-14(20)11(12)3)18-13-7-5-9-17-16(13)19/h4-10,20H,1-3H3
InChIKeyDBYBEGARPGWFQK-UHFFFAOYSA-N
XLogP3.69
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol?
The IUPAC name of 2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol (CID 82829204) is 2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol.
What is the SMILES notation for 2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol?
The canonical SMILES for 2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol is Cc1c(O)cccc1-c1nc2cccnc2n1C(C)C.
What is the InChIKey of 2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol?
The InChIKey is DBYBEGARPGWFQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-10(2)19-15(12-6-4-8-14(20)11(12)3)18-13-7-5-9-17-16(13)19/h4-10,20H,1-3H3.
What are the key properties of 2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol?
2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol has a molecular weight of 267.33 g/mol, XLogP of 3.69, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)phenol is sourced from PubChem (CID 82829204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).