2-ethyl-4-methyl-1,2-oxazolidine

C6H13NO — CID 123680572

IUPAC2-ethyl-4-methyl-1,2-oxazolidine
SMILESCCN1CC(C)CO1
InChIInChI=1S/C6H13NO/c1-3-7-4-6(2)5-8-7/h6H,3-5H2,1-2H3
InChIKeySOFZTMQWFSKIRI-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.89
Rot. Bonds1

About 2-ethyl-4-methyl-1,2-oxazolidine

2-ethyl-4-methyl-1,2-oxazolidine (PubChem CID 123680572) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is 2-ethyl-4-methyl-1,2-oxazolidine.

Molecular Properties

Compound Name2-ethyl-4-methyl-1,2-oxazolidine
PubChem CID123680572
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name2-ethyl-4-methyl-1,2-oxazolidine
SMILESCCN1CC(C)CO1
InChIInChI=1S/C6H13NO/c1-3-7-4-6(2)5-8-7/h6H,3-5H2,1-2H3
InChIKeySOFZTMQWFSKIRI-UHFFFAOYSA-N
XLogP0.89
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-Diethyl-1,2-oxazolidin-2-ium chloride
CID 58721
Isoxazolidine, 2-methyl-
CID 140926
Ethoxypyrrolidine
CID 22475124
Isoxazolidine, 2-(1,1-dimethylethyl)-
CID 144217
(4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine
CID 145228806
2-(3-Fluoropropyl)-4-methyl-1,2-oxazolidine
CID 170951148
(5R)-2-tert-butyl-5-fluoro-1,2-oxazolidine
CID 172097543
2-Tert-butyl-5-fluoro-1,2-oxazolidine
CID 172097637
(5S)-2-tert-butyl-5-fluoro-1,2-oxazolidine
CID 172097738
2-(3-Fluoropropyl)-1,2-oxazolidine
CID 176014940
Butylisoxazolidine
CID 126994308
2,2-Diethyl-1,2-oxazolidin-2-ium
CID 58722

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-methyl-1,2-oxazolidine?
The IUPAC name of 2-ethyl-4-methyl-1,2-oxazolidine (CID 123680572) is 2-ethyl-4-methyl-1,2-oxazolidine.
What is the SMILES notation for 2-ethyl-4-methyl-1,2-oxazolidine?
The canonical SMILES for 2-ethyl-4-methyl-1,2-oxazolidine is CCN1CC(C)CO1.
What is the InChIKey of 2-ethyl-4-methyl-1,2-oxazolidine?
The InChIKey is SOFZTMQWFSKIRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-3-7-4-6(2)5-8-7/h6H,3-5H2,1-2H3.
What are the key properties of 2-ethyl-4-methyl-1,2-oxazolidine?
2-ethyl-4-methyl-1,2-oxazolidine has a molecular weight of 115.18 g/mol, XLogP of 0.89, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-methyl-1,2-oxazolidine is sourced from PubChem (CID 123680572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).