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

C8H13NO2 — CID 11550047

IUPAC(4R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one
SMILESC=CC1OC(=O)N[C@@H]1C(C)C
InChIInChI=1S/C8H13NO2/c1-4-6-7(5(2)3)9-8(10)11-6/h4-7H,1H2,2-3H3,(H,9,10)/t6?,7-/m1/s1
InChIKeyZIOMABMTSSKCDC-COBSHVIPSA-N
MW155.20 g/mol
LogP1.31
Rot. Bonds2

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

(4R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one (PubChem CID 11550047) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is (4R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one
PubChem CID11550047
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name(4R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one
SMILESC=CC1OC(=O)N[C@@H]1C(C)C
InChIInChI=1S/C8H13NO2/c1-4-6-7(5(2)3)9-8(10)11-6/h4-7H,1H2,2-3H3,(H,9,10)/t6?,7-/m1/s1
InChIKeyZIOMABMTSSKCDC-COBSHVIPSA-N
XLogP1.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 51.31
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

(4R,5R)-5-methyl-4-prop-2-enyl-1,3-oxazolidin-2-one
CID 11116158
(4S,5S)-5-ethyl-4-prop-2-enyl-1,3-oxazolidin-2-one
CID 11480568
(4S,5S)-5-methyl-4-prop-2-enyl-1,3-oxazolidin-2-one
CID 15632305
(4R,5S)-5-methyl-4-prop-2-enyl-1,3-oxazolidin-2-one
CID 15632306
(4S,5S)-4,5-bis(ethenyl)-1,3-oxazolidin-2-one
CID 24749117
(4R,5R)-4-tert-butyl-5-ethenyl-1,3-oxazolidin-2-one
CID 102338359
(4R,5S)-4-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-5-ethenyl-1,3-oxazolidin-2-one
CID 134950181
(4R,5R)-5-ethenyl-4-methyl-4-propan-2-yl-1,3-oxazolidin-2-one
CID 134950649
(4R,5R)-5-ethenyl-4-methyl-1,3-oxazolidin-2-one
CID 134950685
tert-butyl N-[2-[(4R,5R)-5-ethenyl-2-oxo-1,3-oxazolidin-4-yl]ethyl]carbamate
CID 134966211
(4R,5R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one
CID 176427136
4(S)-isobutyl-5(S)-vinyl-2-oxazolidinone
CID 10725813

Frequently Asked Questions

What is the IUPAC name of (4R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one?
The IUPAC name of (4R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one (CID 11550047) is (4R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one.
What is the SMILES notation for (4R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one?
The canonical SMILES for (4R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one is C=CC1OC(=O)N[C@@H]1C(C)C.
What is the InChIKey of (4R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one?
The InChIKey is ZIOMABMTSSKCDC-COBSHVIPSA-N. The full InChI is InChI=1S/C8H13NO2/c1-4-6-7(5(2)3)9-8(10)11-6/h4-7H,1H2,2-3H3,(H,9,10)/t6?,7-/m1/s1.
What are the key properties of (4R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one?
(4R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one has a molecular weight of 155.20 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one is sourced from PubChem (CID 11550047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).