(4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine

C8H15NO — CID 170267213

IUPAC(4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine
SMILESC=C[C@H]1COC(C)(C)N1C
InChIInChI=1S/C8H15NO/c1-5-7-6-10-8(2,3)9(7)4/h5,7H,1,6H2,2-4H3/t7-/m0/s1
InChIKeyOFZLYYWFNYRXTH-ZETCQYMHSA-N
MW141.21 g/mol
LogP1.24
Rot. Bonds1

About (4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine

(4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine (PubChem CID 170267213) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine.

Molecular Properties

Compound Name(4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine
PubChem CID170267213
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine
SMILESC=C[C@H]1COC(C)(C)N1C
InChIInChI=1S/C8H15NO/c1-5-7-6-10-8(2,3)9(7)4/h5,7H,1,6H2,2-4H3/t7-/m0/s1
InChIKeyOFZLYYWFNYRXTH-ZETCQYMHSA-N
XLogP1.24
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine?
The IUPAC name of (4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine (CID 170267213) is (4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine.
What is the SMILES notation for (4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine?
The canonical SMILES for (4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine is C=C[C@H]1COC(C)(C)N1C.
What is the InChIKey of (4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine?
The InChIKey is OFZLYYWFNYRXTH-ZETCQYMHSA-N. The full InChI is InChI=1S/C8H15NO/c1-5-7-6-10-8(2,3)9(7)4/h5,7H,1,6H2,2-4H3/t7-/m0/s1.
What are the key properties of (4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine?
(4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine has a molecular weight of 141.21 g/mol, XLogP of 1.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-ethenyl-2,2,3-trimethyl-1,3-oxazolidine is sourced from PubChem (CID 170267213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).