(5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one

C7H11NO2 — CID 134966255

IUPAC(5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one
SMILESC=C[C@H]1OC(=O)NC1(C)C
InChIInChI=1S/C7H11NO2/c1-4-5-7(2,3)8-6(9)10-5/h4-5H,1H2,2-3H3,(H,8,9)/t5-/m1/s1
InChIKeyKWHCDXGNQUBYQB-RXMQYKEDSA-N
MW141.17 g/mol
LogP1.06
Rot. Bonds1

About (5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one

(5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one (PubChem CID 134966255) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is (5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one
PubChem CID134966255
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC Name(5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one
SMILESC=C[C@H]1OC(=O)NC1(C)C
InChIInChI=1S/C7H11NO2/c1-4-5-7(2,3)8-6(9)10-5/h4-5H,1H2,2-3H3,(H,8,9)/t5-/m1/s1
InChIKeyKWHCDXGNQUBYQB-RXMQYKEDSA-N
XLogP1.06
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 51.06
H-Bond Donors ≤ 51
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 (5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one?
The IUPAC name of (5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one (CID 134966255) is (5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one.
What is the SMILES notation for (5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one?
The canonical SMILES for (5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one is C=C[C@H]1OC(=O)NC1(C)C.
What is the InChIKey of (5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one?
The InChIKey is KWHCDXGNQUBYQB-RXMQYKEDSA-N. The full InChI is InChI=1S/C7H11NO2/c1-4-5-7(2,3)8-6(9)10-5/h4-5H,1H2,2-3H3,(H,8,9)/t5-/m1/s1.
What are the key properties of (5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one?
(5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one has a molecular weight of 141.17 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-ethenyl-4,4-dimethyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 134966255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).