1-(azetidin-3-yl)piperidine

C8H16N2 — CID 19391152

IUPAC1-(azetidin-3-yl)piperidine
SMILESC1CCN(C2CNC2)CC1
InChIInChI=1S/C8H16N2/c1-2-4-10(5-3-1)8-6-9-7-8/h8-9H,1-7H2
InChIKeySRYMNAQUZAVQFT-UHFFFAOYSA-N
MW140.23 g/mol
LogP0.44
Rot. Bonds1

About 1-(azetidin-3-yl)piperidine

1-(azetidin-3-yl)piperidine (PubChem CID 19391152) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 1-(azetidin-3-yl)piperidine.

Molecular Properties

Compound Name1-(azetidin-3-yl)piperidine
PubChem CID19391152
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name1-(azetidin-3-yl)piperidine
SMILESC1CCN(C2CNC2)CC1
InChIInChI=1S/C8H16N2/c1-2-4-10(5-3-1)8-6-9-7-8/h8-9H,1-7H2
InChIKeySRYMNAQUZAVQFT-UHFFFAOYSA-N
XLogP0.44
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)piperidine?
The IUPAC name of 1-(azetidin-3-yl)piperidine (CID 19391152) is 1-(azetidin-3-yl)piperidine.
What is the SMILES notation for 1-(azetidin-3-yl)piperidine?
The canonical SMILES for 1-(azetidin-3-yl)piperidine is C1CCN(C2CNC2)CC1.
What is the InChIKey of 1-(azetidin-3-yl)piperidine?
The InChIKey is SRYMNAQUZAVQFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-2-4-10(5-3-1)8-6-9-7-8/h8-9H,1-7H2.
What are the key properties of 1-(azetidin-3-yl)piperidine?
1-(azetidin-3-yl)piperidine has a molecular weight of 140.23 g/mol, XLogP of 0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)piperidine is sourced from PubChem (CID 19391152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).