3-ethoxyazetidine

C5H11NO — CID 22507733

IUPAC3-ethoxyazetidine
SMILESCCOC1CNC1
InChIInChI=1S/C5H11NO/c1-2-7-5-3-6-4-5/h5-6H,2-4H2,1H3
InChIKeyMIGAFYXADJBZDV-UHFFFAOYSA-N
MW101.15 g/mol
LogP-0.01
Rot. Bonds2

About 3-ethoxyazetidine

3-ethoxyazetidine (PubChem CID 22507733) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is 3-ethoxyazetidine.

Molecular Properties

Compound Name3-ethoxyazetidine
PubChem CID22507733
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name3-ethoxyazetidine
SMILESCCOC1CNC1
InChIInChI=1S/C5H11NO/c1-2-7-5-3-6-4-5/h5-6H,2-4H2,1H3
InChIKeyMIGAFYXADJBZDV-UHFFFAOYSA-N
XLogP-0.01
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethoxypyrrolidine
CID 21333172
(3S)-3-ethoxypyrrolidine
CID 11116030
ethane;3-ethoxypyrrolidine
CID 142624915
(3S,4R)-3,4-diethoxypyrrolidine;hydrochloride
CID 66592002
3-(2-methylpropoxy)azetidine;hydrochloride
CID 67154547
(2S,4S)-4-ethoxy-2-propylpyrrolidine
CID 99994308
(2R,4S)-4-ethoxy-2-(2-methylpropyl)pyrrolidine
CID 99994354
3-[(2-methylcyclopropyl)methoxy]azetidine
CID 165499801
3-ethoxy-6-azabicyclo[3.1.1]heptane
CID 169176949
(2S,4R)-2-butyl-4-ethoxypyrrolidine
CID 99994328
2,2-dimethylpropanoic acid;(3R)-3-ethoxypyrrolidine
CID 174626759
ethane;6-ethoxy-2-azaspiro[3.3]heptane
CID 170737877

Frequently Asked Questions

What is the IUPAC name of 3-ethoxyazetidine?
The IUPAC name of 3-ethoxyazetidine (CID 22507733) is 3-ethoxyazetidine.
What is the SMILES notation for 3-ethoxyazetidine?
The canonical SMILES for 3-ethoxyazetidine is CCOC1CNC1.
What is the InChIKey of 3-ethoxyazetidine?
The InChIKey is MIGAFYXADJBZDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c1-2-7-5-3-6-4-5/h5-6H,2-4H2,1H3.
What are the key properties of 3-ethoxyazetidine?
3-ethoxyazetidine has a molecular weight of 101.15 g/mol, XLogP of -0.01, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxyazetidine is sourced from PubChem (CID 22507733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).