1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride

C7H16Cl2N2O — CID 68976963

IUPAC1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride
SMILESCl.Cl.OC1CCN(C2CNC2)C1
InChIInChI=1S/C7H14N2O.2ClH/c10-7-1-2-9(5-7)6-3-8-4-6;;/h6-8,10H,1-5H2;2*1H
InChIKeyONAHRXWPLYFOOB-UHFFFAOYSA-N
MW215.12 g/mol
LogP-0.13
Rot. Bonds1

About 1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride

1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride (PubChem CID 68976963) has the molecular formula C7H16Cl2N2O and a molecular weight of 215.12 g/mol. Its IUPAC name is 1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride.

Molecular Properties

Compound Name1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride
PubChem CID68976963
Molecular FormulaC7H16Cl2N2O
Molecular Weight215.12 g/mol
Exact Mass214.06
IUPAC Name1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride
SMILESCl.Cl.OC1CCN(C2CNC2)C1
InChIInChI=1S/C7H14N2O.2ClH/c10-7-1-2-9(5-7)6-3-8-4-6;;/h6-8,10H,1-5H2;2*1H
InChIKeyONAHRXWPLYFOOB-UHFFFAOYSA-N
XLogP-0.13
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.12
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride 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-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride?
The IUPAC name of 1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride (CID 68976963) is 1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride.
What is the SMILES notation for 1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride?
The canonical SMILES for 1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride is Cl.Cl.OC1CCN(C2CNC2)C1.
What is the InChIKey of 1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride?
The InChIKey is ONAHRXWPLYFOOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O.2ClH/c10-7-1-2-9(5-7)6-3-8-4-6;;/h6-8,10H,1-5H2;2*1H.
What are the key properties of 1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride?
1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride has a molecular weight of 215.12 g/mol, XLogP of -0.13, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)pyrrolidin-3-ol;dihydrochloride is sourced from PubChem (CID 68976963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).