2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol

C11H16N2O3 — CID 115919696

IUPAC2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol
SMILESCc1ccc(O)c(CNC2COCC2O)n1
InChIInChI=1S/C11H16N2O3/c1-7-2-3-10(14)8(13-7)4-12-9-5-16-6-11(9)15/h2-3,9,11-12,14-15H,4-6H2,1H3
InChIKeyHPHHJHUBENMXIU-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.06
Rot. Bonds3

About 2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol

2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol (PubChem CID 115919696) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol.

Molecular Properties

Compound Name2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol
PubChem CID115919696
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol
SMILESCc1ccc(O)c(CNC2COCC2O)n1
InChIInChI=1S/C11H16N2O3/c1-7-2-3-10(14)8(13-7)4-12-9-5-16-6-11(9)15/h2-3,9,11-12,14-15H,4-6H2,1H3
InChIKeyHPHHJHUBENMXIU-UHFFFAOYSA-N
XLogP-0.06
TPSA74.61 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol 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-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol?
The IUPAC name of 2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol (CID 115919696) is 2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol.
What is the SMILES notation for 2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol?
The canonical SMILES for 2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol is Cc1ccc(O)c(CNC2COCC2O)n1.
What is the InChIKey of 2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol?
The InChIKey is HPHHJHUBENMXIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-7-2-3-10(14)8(13-7)4-12-9-5-16-6-11(9)15/h2-3,9,11-12,14-15H,4-6H2,1H3.
What are the key properties of 2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol?
2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol has a molecular weight of 224.26 g/mol, XLogP of -0.06, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(4-hydroxyoxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol is sourced from PubChem (CID 115919696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).