1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol

C10H14N2O — CID 83816773

IUPAC1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol
SMILESCN1CC(O)(Cc2cccnc2)C1
InChIInChI=1S/C10H14N2O/c1-12-7-10(13,8-12)5-9-3-2-4-11-6-9/h2-4,6,13H,5,7-8H2,1H3
InChIKeyHFUFNCKPLVQLTF-UHFFFAOYSA-N
MW178.24 g/mol
LogP0.30
Rot. Bonds2

About 1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol

1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol (PubChem CID 83816773) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is 1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol.

Molecular Properties

Compound Name1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol
PubChem CID83816773
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol
SMILESCN1CC(O)(Cc2cccnc2)C1
InChIInChI=1S/C10H14N2O/c1-12-7-10(13,8-12)5-9-3-2-4-11-6-9/h2-4,6,13H,5,7-8H2,1H3
InChIKeyHFUFNCKPLVQLTF-UHFFFAOYSA-N
XLogP0.30
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-methyl-3-(pyridin-3-ylmethyl)azetidin-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 1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol?
The IUPAC name of 1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol (CID 83816773) is 1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol.
What is the SMILES notation for 1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol?
The canonical SMILES for 1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol is CN1CC(O)(Cc2cccnc2)C1.
What is the InChIKey of 1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol?
The InChIKey is HFUFNCKPLVQLTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-12-7-10(13,8-12)5-9-3-2-4-11-6-9/h2-4,6,13H,5,7-8H2,1H3.
What are the key properties of 1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol?
1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol has a molecular weight of 178.24 g/mol, XLogP of 0.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(pyridin-3-ylmethyl)azetidin-3-ol is sourced from PubChem (CID 83816773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).