3-ethoxy-3-methylazetidine

C6H13NO — CID 83066072

IUPAC3-ethoxy-3-methylazetidine
SMILESCCOC1(C)CNC1
InChIInChI=1S/C6H13NO/c1-3-8-6(2)4-7-5-6/h7H,3-5H2,1-2H3
InChIKeyASXVCTNOIKOUIL-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.38
Rot. Bonds2

About 3-ethoxy-3-methylazetidine

3-ethoxy-3-methylazetidine (PubChem CID 83066072) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is 3-ethoxy-3-methylazetidine.

Molecular Properties

Compound Name3-ethoxy-3-methylazetidine
PubChem CID83066072
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name3-ethoxy-3-methylazetidine
SMILESCCOC1(C)CNC1
InChIInChI=1S/C6H13NO/c1-3-8-6(2)4-7-5-6/h7H,3-5H2,1-2H3
InChIKeyASXVCTNOIKOUIL-UHFFFAOYSA-N
XLogP0.38
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Isopropoxy-Azetidine
CID 51358586
3-Ethoxyazetidine hydrochloride
CID 22507732
3-Methoxy-3-methylazetidine hydrochloride
CID 53346546
3-(Tert-butoxy)azetidine hydrochloride
CID 71755657
3-Ethoxy-3-methylazetidine hydrochloride
CID 124124155
3-Isopropoxyazetidine hydrochloride
CID 53249190
3-[(2-Methylbutan-2-yl)oxy]azetidine
CID 62784077
3-(Difluoromethoxy)-3-methylazetidine
CID 114782806
3-(Fluoromethyl)-3-methoxyazetidine hydrochloride
CID 139022684
3-Cyclopropoxy-3-methylazetidine hydrochloride
CID 170907322
3-Methoxy-3-(methoxymethyl)azetidine;hydrochloride
CID 170914539
3-Ethoxyazetidine
CID 22507733

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-3-methylazetidine?
The IUPAC name of 3-ethoxy-3-methylazetidine (CID 83066072) is 3-ethoxy-3-methylazetidine.
What is the SMILES notation for 3-ethoxy-3-methylazetidine?
The canonical SMILES for 3-ethoxy-3-methylazetidine is CCOC1(C)CNC1.
What is the InChIKey of 3-ethoxy-3-methylazetidine?
The InChIKey is ASXVCTNOIKOUIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-3-8-6(2)4-7-5-6/h7H,3-5H2,1-2H3.
What are the key properties of 3-ethoxy-3-methylazetidine?
3-ethoxy-3-methylazetidine has a molecular weight of 115.18 g/mol, XLogP of 0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-3-methylazetidine is sourced from PubChem (CID 83066072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).