3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine

C14H27N — CID 130320709

IUPAC3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine
SMILESCCC1CCC(CN2CC(CC)C2)CC1
InChIInChI=1S/C14H27N/c1-3-12-5-7-14(8-6-12)11-15-9-13(4-2)10-15/h12-14H,3-11H2,1-2H3
InChIKeyLIQKSGLRFJKHBG-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.54
Rot. Bonds4

About 3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine

3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine (PubChem CID 130320709) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine.

Molecular Properties

Compound Name3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine
PubChem CID130320709
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine
SMILESCCC1CCC(CN2CC(CC)C2)CC1
InChIInChI=1S/C14H27N/c1-3-12-5-7-14(8-6-12)11-15-9-13(4-2)10-15/h12-14H,3-11H2,1-2H3
InChIKeyLIQKSGLRFJKHBG-UHFFFAOYSA-N
XLogP3.54
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(3-ethylazetidin-1-yl)methyl]-N-methylcyclohexan-1-amine
CID 155331377
(3S,5S)-1-(cyclopropylmethyl)-5-ethylpiperidin-3-ol
CID 138739789
1-[1-[(4-ethylcyclohexyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine
CID 62513783
1-[(4-ethylcyclohexyl)methyl]-4-methylpiperidine
CID 167550394
1-(cyclopropylmethyl)-5-ethyl-N-propylpiperidin-3-amine
CID 83991199
1-(cyclobutylmethyl)-3-ethylpiperidine
CID 143174975
ethane;ethylcyclopropane
CID 91380076
azane;ethylcyclopropane
CID 20975579
3-ethyl-1-[(4-fluorocyclohexyl)methyl]piperidine
CID 163155823
1-(cyclopropylmethyl)-5-ethyl-N-(3-methylbutyl)piperidin-3-amine
CID 83995985
ethane;4-[(3-ethylazetidin-1-yl)methyl]-1-phenylpiperidine
CID 171069599
N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide
CID 112541972

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine?
The IUPAC name of 3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine (CID 130320709) is 3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine.
What is the SMILES notation for 3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine?
The canonical SMILES for 3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine is CCC1CCC(CN2CC(CC)C2)CC1.
What is the InChIKey of 3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine?
The InChIKey is LIQKSGLRFJKHBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-3-12-5-7-14(8-6-12)11-15-9-13(4-2)10-15/h12-14H,3-11H2,1-2H3.
What are the key properties of 3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine?
3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine has a molecular weight of 209.38 g/mol, XLogP of 3.54, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-[(4-ethylcyclohexyl)methyl]azetidine is sourced from PubChem (CID 130320709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).