2-ethenyl-4,4-dimethyl-1,3-oxazolidine

C7H13NO — CID 174381572

IUPAC2-ethenyl-4,4-dimethyl-1,3-oxazolidine
SMILESC=CC1NC(C)(C)CO1
InChIInChI=1S/C7H13NO/c1-4-6-8-7(2,3)5-9-6/h4,6,8H,1,5H2,2-3H3
InChIKeyWOGDZQUSPJZEQA-UHFFFAOYSA-N
MW127.19 g/mol
LogP0.90
Rot. Bonds1

About 2-ethenyl-4,4-dimethyl-1,3-oxazolidine

2-ethenyl-4,4-dimethyl-1,3-oxazolidine (PubChem CID 174381572) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is 2-ethenyl-4,4-dimethyl-1,3-oxazolidine.

Molecular Properties

Compound Name2-ethenyl-4,4-dimethyl-1,3-oxazolidine
PubChem CID174381572
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name2-ethenyl-4,4-dimethyl-1,3-oxazolidine
SMILESC=CC1NC(C)(C)CO1
InChIInChI=1S/C7H13NO/c1-4-6-8-7(2,3)5-9-6/h4,6,8H,1,5H2,2-3H3
InChIKeyWOGDZQUSPJZEQA-UHFFFAOYSA-N
XLogP0.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-Vinyloxazolidine
CID 18769646
(4R)-4-ethyl-2-[(E)-prop-1-enyl]-1,3-oxazolidine
CID 10678340
2-(1-Methoxyvinyl)-4,4-dimethyloxazolidine
CID 85991398
2-[(E)-prop-1-enyl]-1,3-oxazolidine
CID 20379785
2,4,4-Trimethyl-3-prop-2-enyl-1,3-oxazolidin-3-ium bromide
CID 21280647
2-Prop-1-en-2-yl-1,3-oxazolidine
CID 54277332
5-Ethenyl-2,2-dimethyl-1,3-oxazolidine
CID 57128867
4-Methyl-2-prop-1-en-2-yl-1,3-oxazolidine
CID 68827199
4-Ethyl-2-prop-1-en-2-yl-1,3-oxazolidine
CID 68827316
2-Ethenyl-4-ethyl-1,3-oxazolidine
CID 68829416
2-Ethenyl-5-ethyl-1,3-oxazolidine
CID 68829548
5-Methyl-2-prop-1-en-2-yl-1,3-oxazolidine
CID 68830433

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-4,4-dimethyl-1,3-oxazolidine?
The IUPAC name of 2-ethenyl-4,4-dimethyl-1,3-oxazolidine (CID 174381572) is 2-ethenyl-4,4-dimethyl-1,3-oxazolidine.
What is the SMILES notation for 2-ethenyl-4,4-dimethyl-1,3-oxazolidine?
The canonical SMILES for 2-ethenyl-4,4-dimethyl-1,3-oxazolidine is C=CC1NC(C)(C)CO1.
What is the InChIKey of 2-ethenyl-4,4-dimethyl-1,3-oxazolidine?
The InChIKey is WOGDZQUSPJZEQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-4-6-8-7(2,3)5-9-6/h4,6,8H,1,5H2,2-3H3.
What are the key properties of 2-ethenyl-4,4-dimethyl-1,3-oxazolidine?
2-ethenyl-4,4-dimethyl-1,3-oxazolidine has a molecular weight of 127.19 g/mol, XLogP of 0.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-4,4-dimethyl-1,3-oxazolidine is sourced from PubChem (CID 174381572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).