3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol

C14H14N4O2 — CID 70573569

IUPAC3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol
SMILESOCC(O)Cn1cnc2ncc(-c3ccncc3)cc21
InChIInChI=1S/C14H14N4O2/c19-8-12(20)7-18-9-17-14-13(18)5-11(6-16-14)10-1-3-15-4-2-10/h1-6,9,12,19-20H,7-8H2
InChIKeyYSLXQDIQJLXKDK-UHFFFAOYSA-N
MW270.29 g/mol
LogP0.85
Rot. Bonds4

About 3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol

3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol (PubChem CID 70573569) has the molecular formula C14H14N4O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is 3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol.

Molecular Properties

Compound Name3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol
PubChem CID70573569
Molecular FormulaC14H14N4O2
Molecular Weight270.29 g/mol
Exact Mass270.11
IUPAC Name3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol
SMILESOCC(O)Cn1cnc2ncc(-c3ccncc3)cc21
InChIInChI=1S/C14H14N4O2/c19-8-12(20)7-18-9-17-14-13(18)5-11(6-16-14)10-1-3-15-4-2-10/h1-6,9,12,19-20H,7-8H2
InChIKeyYSLXQDIQJLXKDK-UHFFFAOYSA-N
XLogP0.85
TPSA84.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol 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-Amino-1-Methyl-6-Phenylimidazo(4,5-b)Pyridine
CID 1530
Glu-P 1
CID 49971
2-(Hydroxyamino)-1-methyl-6-phenylimidazo(4,5-b)pyridine
CID 104954
Fadraciclib
CID 24983461
(2R)-2-({9-(1-methylethyl)-6-[(4-pyridin-2-ylbenzyl)amino]-9H-purin-2-yl}amino)butan-1-ol
CID 10224714
(2R,3S)-3-[[9-propan-2-yl-6-(pyridin-3-ylmethylamino)purin-2-yl]amino]pentan-2-ol
CID 9842276
(3RS,4R)-4-{9-Isopropyl-6-[(pyridin-3-ylmethyl)-amino]-9H-purin-2-ylamino}-hexan-3-ol
CID 12111409
(3RS,4R)-4-{9-Isopropyl-6-[(pyridin-3-ylmethyl)-amino]-9H-purin-2-ylamino}-2-methyl-hexan-3-ol
CID 12111411
(3RS,4R)-4-{9-Isopropyl-6-[(pyridin-3-ylmethyl)-amino]-9H-purin-2-ylamino}-2,2-dimethyl-hexan-3-ol
CID 12111413
(2R)-2-{[9-(propan-2-yl)-6-{[4-(pyridin-2-yl)phenyl]amino}-9H-purin-2-yl]amino}butan-1-ol
CID 25053130
(2S)-2-[[9-propan-2-yl-6-[[4-(2-pyridinyl)phenyl]methylamino]-2-purinyl]amino]-1-butanol
CID 25211051
2-{[3-(2-Aminopyrimidin-4-yl)-2-(4-fluorophenyl)-imidazo[1,2-a]pyridin-7-ylmethyl]methylamino}ethanol
CID 24887880

Frequently Asked Questions

What is the IUPAC name of 3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol?
The IUPAC name of 3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol (CID 70573569) is 3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol.
What is the SMILES notation for 3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol?
The canonical SMILES for 3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol is OCC(O)Cn1cnc2ncc(-c3ccncc3)cc21.
What is the InChIKey of 3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol?
The InChIKey is YSLXQDIQJLXKDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2/c19-8-12(20)7-18-9-17-14-13(18)5-11(6-16-14)10-1-3-15-4-2-10/h1-6,9,12,19-20H,7-8H2.
What are the key properties of 3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol?
3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol has a molecular weight of 270.29 g/mol, XLogP of 0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-pyridin-4-ylimidazo[4,5-b]pyridin-1-yl)propane-1,2-diol is sourced from PubChem (CID 70573569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).