1,3-diazetidin-2-ol

C2H6N2O — CID 153343203

IUPAC1,3-diazetidin-2-ol
SMILESOC1NCN1
InChIInChI=1S/C2H6N2O/c5-2-3-1-4-2/h2-5H,1H2
InChIKeyATNXLYIZLWMDMD-UHFFFAOYSA-N
MW74.08 g/mol
LogP-1.59
Rot. Bonds

About 1,3-diazetidin-2-ol

1,3-diazetidin-2-ol (PubChem CID 153343203) has the molecular formula C2H6N2O and a molecular weight of 74.08 g/mol. Its IUPAC name is 1,3-diazetidin-2-ol.

Molecular Properties

Compound Name1,3-diazetidin-2-ol
PubChem CID153343203
Molecular FormulaC2H6N2O
Molecular Weight74.08 g/mol
Exact Mass74.05
IUPAC Name1,3-diazetidin-2-ol
SMILESOC1NCN1
InChIInChI=1S/C2H6N2O/c5-2-3-1-4-2/h2-5H,1H2
InChIKeyATNXLYIZLWMDMD-UHFFFAOYSA-N
XLogP-1.59
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50074.08
LogP ≤ 5-1.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1,3-diazetidin-2-ol 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

2,3,3a,4,5,6,7,7a-octahydro-1H-pyrazolo[3,4-d]pyrimidin-4-ol
CID 101060487
5-bromo-1,2,4-triazolidin-3-ol
CID 170906450
(3S)-4-bromodiazetidin-3-ol
CID 174114559
2,4-dichloro-1,3,5-triazinane
CID 140579479
5-methyl-1,3-diazinane-2,4-diol
CID 5247804
[(4S,5R)-5-acetyloxyimidazolidin-4-yl] acetate
CID 94839790
(1R,4S,5R,6S)-2,3-diazabicyclo[2.2.1]heptane-5,6-diol;hydrochloride
CID 139022492
2,3,3a,4,7,7a-hexahydro-1H-benzimidazole
CID 18940968
4-[(2-hydroxy-1,3-diazinan-4-yl)oxy]-1,3-diazinan-2-ol
CID 70584996
thiadiazepane-4,5-diol
CID 142545397
2,3,3a,4,6,6a-hexahydro-1H-imidazo[4,5-d]imidazol-5-one
CID 15040712
pyrrolidine-2,3,4-triol
CID 73110172

Frequently Asked Questions

What is the IUPAC name of 1,3-diazetidin-2-ol?
The IUPAC name of 1,3-diazetidin-2-ol (CID 153343203) is 1,3-diazetidin-2-ol.
What is the SMILES notation for 1,3-diazetidin-2-ol?
The canonical SMILES for 1,3-diazetidin-2-ol is OC1NCN1.
What is the InChIKey of 1,3-diazetidin-2-ol?
The InChIKey is ATNXLYIZLWMDMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6N2O/c5-2-3-1-4-2/h2-5H,1H2.
What are the key properties of 1,3-diazetidin-2-ol?
1,3-diazetidin-2-ol has a molecular weight of 74.08 g/mol, XLogP of -1.59, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diazetidin-2-ol is sourced from PubChem (CID 153343203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).