1-(4-ethoxycyclohexyl)azetidine

C11H21NO — CID 123809059

IUPAC1-(4-ethoxycyclohexyl)azetidine
SMILESCCOC1CCC(N2CCC2)CC1
InChIInChI=1S/C11H21NO/c1-2-13-11-6-4-10(5-7-11)12-8-3-9-12/h10-11H,2-9H2,1H3
InChIKeyZAUJNSSGJUFCOK-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.04
Rot. Bonds3

About 1-(4-ethoxycyclohexyl)azetidine

1-(4-ethoxycyclohexyl)azetidine (PubChem CID 123809059) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 1-(4-ethoxycyclohexyl)azetidine.

Molecular Properties

Compound Name1-(4-ethoxycyclohexyl)azetidine
PubChem CID123809059
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name1-(4-ethoxycyclohexyl)azetidine
SMILESCCOC1CCC(N2CCC2)CC1
InChIInChI=1S/C11H21NO/c1-2-13-11-6-4-10(5-7-11)12-8-3-9-12/h10-11H,2-9H2,1H3
InChIKeyZAUJNSSGJUFCOK-UHFFFAOYSA-N
XLogP2.04
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(4-ethoxycyclohexyl)azetidine 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-(4-ethoxycyclohexyl)azetidine?
The IUPAC name of 1-(4-ethoxycyclohexyl)azetidine (CID 123809059) is 1-(4-ethoxycyclohexyl)azetidine.
What is the SMILES notation for 1-(4-ethoxycyclohexyl)azetidine?
The canonical SMILES for 1-(4-ethoxycyclohexyl)azetidine is CCOC1CCC(N2CCC2)CC1.
What is the InChIKey of 1-(4-ethoxycyclohexyl)azetidine?
The InChIKey is ZAUJNSSGJUFCOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-2-13-11-6-4-10(5-7-11)12-8-3-9-12/h10-11H,2-9H2,1H3.
What are the key properties of 1-(4-ethoxycyclohexyl)azetidine?
1-(4-ethoxycyclohexyl)azetidine has a molecular weight of 183.29 g/mol, XLogP of 2.04, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxycyclohexyl)azetidine is sourced from PubChem (CID 123809059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).