1-(1-ethylazetidin-3-yl)piperidine

C10H20N2 — CID 69087799

IUPAC1-(1-ethylazetidin-3-yl)piperidine
SMILESCCN1CC(N2CCCCC2)C1
InChIInChI=1S/C10H20N2/c1-2-11-8-10(9-11)12-6-4-3-5-7-12/h10H,2-9H2,1H3
InChIKeyBBRLSUGUUFJKAF-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.18
Rot. Bonds2

About 1-(1-ethylazetidin-3-yl)piperidine

1-(1-ethylazetidin-3-yl)piperidine (PubChem CID 69087799) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-(1-ethylazetidin-3-yl)piperidine.

Molecular Properties

Compound Name1-(1-ethylazetidin-3-yl)piperidine
PubChem CID69087799
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name1-(1-ethylazetidin-3-yl)piperidine
SMILESCCN1CC(N2CCCCC2)C1
InChIInChI=1S/C10H20N2/c1-2-11-8-10(9-11)12-6-4-3-5-7-12/h10H,2-9H2,1H3
InChIKeyBBRLSUGUUFJKAF-UHFFFAOYSA-N
XLogP1.18
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylazetidin-3-yl)piperidine?
The IUPAC name of 1-(1-ethylazetidin-3-yl)piperidine (CID 69087799) is 1-(1-ethylazetidin-3-yl)piperidine.
What is the SMILES notation for 1-(1-ethylazetidin-3-yl)piperidine?
The canonical SMILES for 1-(1-ethylazetidin-3-yl)piperidine is CCN1CC(N2CCCCC2)C1.
What is the InChIKey of 1-(1-ethylazetidin-3-yl)piperidine?
The InChIKey is BBRLSUGUUFJKAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-2-11-8-10(9-11)12-6-4-3-5-7-12/h10H,2-9H2,1H3.
What are the key properties of 1-(1-ethylazetidin-3-yl)piperidine?
1-(1-ethylazetidin-3-yl)piperidine has a molecular weight of 168.28 g/mol, XLogP of 1.18, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylazetidin-3-yl)piperidine is sourced from PubChem (CID 69087799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).