3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride

C11H21ClN2 — CID 166507443

IUPAC3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride
SMILESC1CC(C2CNC2)CN(C2CC2)C1.Cl
InChIInChI=1S/C11H20N2.ClH/c1-2-9(10-6-12-7-10)8-13(5-1)11-3-4-11;/h9-12H,1-8H2;1H
InChIKeyVHGOHMCRFNWXSI-UHFFFAOYSA-N
MW216.76 g/mol
LogP1.50
Rot. Bonds2

About 3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride

3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride (PubChem CID 166507443) has the molecular formula C11H21ClN2 and a molecular weight of 216.76 g/mol. Its IUPAC name is 3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride.

Molecular Properties

Compound Name3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride
PubChem CID166507443
Molecular FormulaC11H21ClN2
Molecular Weight216.76 g/mol
Exact Mass216.14
IUPAC Name3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride
SMILESC1CC(C2CNC2)CN(C2CC2)C1.Cl
InChIInChI=1S/C11H20N2.ClH/c1-2-9(10-6-12-7-10)8-13(5-1)11-3-4-11;/h9-12H,1-8H2;1H
InChIKeyVHGOHMCRFNWXSI-UHFFFAOYSA-N
XLogP1.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.76
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride?
The IUPAC name of 3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride (CID 166507443) is 3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride.
What is the SMILES notation for 3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride?
The canonical SMILES for 3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride is C1CC(C2CNC2)CN(C2CC2)C1.Cl.
What is the InChIKey of 3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride?
The InChIKey is VHGOHMCRFNWXSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2.ClH/c1-2-9(10-6-12-7-10)8-13(5-1)11-3-4-11;/h9-12H,1-8H2;1H.
What are the key properties of 3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride?
3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride has a molecular weight of 216.76 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(azetidin-3-yl)-1-cyclopropylpiperidine;hydrochloride is sourced from PubChem (CID 166507443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).