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

C18H20N4O — CID 117165211

IUPAC2-[(3-piperidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol
SMILESOc1ccccc1Cc1nc2cccnc2n1C1CCCNC1
InChIInChI=1S/C18H20N4O/c23-16-8-2-1-5-13(16)11-17-21-15-7-4-10-20-18(15)22(17)14-6-3-9-19-12-14/h1-2,4-5,7-8,10,14,19,23H,3,6,9,11-12H2
InChIKeyNTYUOMFCJOGKQU-UHFFFAOYSA-N
MW308.38 g/mol
LogP2.65
Rot. Bonds3

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

2-[(3-piperidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol (PubChem CID 117165211) has the molecular formula C18H20N4O and a molecular weight of 308.38 g/mol. Its IUPAC name is 2-[(3-piperidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol.

Molecular Properties

Compound Name2-[(3-piperidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol
PubChem CID117165211
Molecular FormulaC18H20N4O
Molecular Weight308.38 g/mol
Exact Mass308.16
IUPAC Name2-[(3-piperidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol
SMILESOc1ccccc1Cc1nc2cccnc2n1C1CCCNC1
InChIInChI=1S/C18H20N4O/c23-16-8-2-1-5-13(16)11-17-21-15-7-4-10-20-18(15)22(17)14-6-3-9-19-12-14/h1-2,4-5,7-8,10,14,19,23H,3,6,9,11-12H2
InChIKeyNTYUOMFCJOGKQU-UHFFFAOYSA-N
XLogP2.65
TPSA62.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

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

Launch Full Analysis

Related Compounds

2-[(1-methylpiperidin-4-yl)methyl]-3-piperidin-3-ylimidazo[4,5-b]pyridine
CID 117161555
3-[(3-pyrrolidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol
CID 117164918
4-[(3-piperidin-4-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol
CID 117165404
3-(1-methylpiperidin-3-yl)-2-(piperidin-4-ylmethyl)imidazo[4,5-b]pyridine
CID 117161554
2-[(2-methylphenyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridine
CID 117165228
3-pyrrolidin-2-yl-2-(pyrrolidin-3-ylmethyl)imidazo[4,5-b]pyridine
CID 117161180
2-[(1-ethylpiperidin-2-yl)methyl]-3-pyrrolidin-3-ylimidazo[4,5-b]pyridine
CID 117163622
2-(3-cycloheptylimidazo[4,5-b]pyridin-2-yl)ethanamine
CID 82483690
2-[[3-(furan-2-yl)imidazo[4,5-b]pyridin-2-yl]methyl]phenol
CID 117165248
2-[(2-chlorophenyl)methyl]-3-(oxolan-3-yl)imidazo[4,5-b]pyridine
CID 117165183
2-[(2-fluorophenyl)methyl]-3-(oxolan-3-yl)imidazo[4,5-b]pyridine
CID 117165182
(3-cyclohexylimidazo[4,5-b]pyridin-2-yl)methanamine
CID 82474489

Frequently Asked Questions

What is the IUPAC name of 2-[(3-piperidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol?
The IUPAC name of 2-[(3-piperidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol (CID 117165211) is 2-[(3-piperidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol.
What is the SMILES notation for 2-[(3-piperidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol?
The canonical SMILES for 2-[(3-piperidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol is Oc1ccccc1Cc1nc2cccnc2n1C1CCCNC1.
What is the InChIKey of 2-[(3-piperidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol?
The InChIKey is NTYUOMFCJOGKQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O/c23-16-8-2-1-5-13(16)11-17-21-15-7-4-10-20-18(15)22(17)14-6-3-9-19-12-14/h1-2,4-5,7-8,10,14,19,23H,3,6,9,11-12H2.
What are the key properties of 2-[(3-piperidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol?
2-[(3-piperidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol has a molecular weight of 308.38 g/mol, XLogP of 2.65, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-piperidin-3-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol is sourced from PubChem (CID 117165211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).