(5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one

C8H13NO2 — CID 59735391

IUPAC(5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one
SMILESC=CCN1C[C@@H](CC)OC1=O
InChIInChI=1S/C8H13NO2/c1-3-5-9-6-7(4-2)11-8(9)10/h3,7H,1,4-6H2,2H3/t7-/m1/s1
InChIKeyOMZTYGIVKQEFEB-SSDOTTSWSA-N
MW155.20 g/mol
LogP1.40
Rot. Bonds3

About (5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one

(5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one (PubChem CID 59735391) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is (5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one
PubChem CID59735391
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name(5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one
SMILESC=CCN1C[C@@H](CC)OC1=O
InChIInChI=1S/C8H13NO2/c1-3-5-9-6-7(4-2)11-8(9)10/h3,7H,1,4-6H2,2H3/t7-/m1/s1
InChIKeyOMZTYGIVKQEFEB-SSDOTTSWSA-N
XLogP1.40
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-Butyl-5-methyleneoxazolidin-2-one
CID 10702044
Vinylmethyloxazolidinone
CID 11446331
3-Butyl-5-methyl-1,3-oxazolidin-2-one
CID 13432449
3-Allyl-5-methyl-1,3-oxazolidin-2-one
CID 534901
N-methylallyloxazolidinone
CID 132280368
3-[(Z)-but-2-enyl]-1,3-oxazolidin-2-one
CID 132539503
Prop-2-enyl 3-methoxypyrrolidine-1-carboxylate
CID 19915008
5-Ethyl-3-(1-methoxyethyl)-1,3-oxazolidin-2-one
CID 21464463
5-Methyl-3-(2-methylprop-2-enyl)-1,3-oxazolidin-2-one
CID 22133409
3-Butyl-4-ethenyl-1,3-oxazolidin-2-one
CID 22891809
4-Ethenyl-3-propyl-1,3-oxazolidin-2-one
CID 22891812
Prop-2-enyl 3-(dimethylcarbamoyloxy)pyrrolidine-1-carboxylate
CID 54389080

Frequently Asked Questions

What is the IUPAC name of (5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one?
The IUPAC name of (5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one (CID 59735391) is (5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one.
What is the SMILES notation for (5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one?
The canonical SMILES for (5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one is C=CCN1C[C@@H](CC)OC1=O.
What is the InChIKey of (5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one?
The InChIKey is OMZTYGIVKQEFEB-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H13NO2/c1-3-5-9-6-7(4-2)11-8(9)10/h3,7H,1,4-6H2,2H3/t7-/m1/s1.
What are the key properties of (5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one?
(5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one has a molecular weight of 155.20 g/mol, XLogP of 1.40, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-ethyl-3-prop-2-enyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 59735391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).