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

C11H17NO2 — CID 134966187

IUPAC(4R,5R)-4-cyclohexyl-5-ethenyl-1,3-oxazolidin-2-one
SMILESC=C[C@H]1OC(=O)N[C@@H]1C1CCCCC1
InChIInChI=1S/C11H17NO2/c1-2-9-10(12-11(13)14-9)8-6-4-3-5-7-8/h2,8-10H,1,3-7H2,(H,12,13)/t9-,10-/m1/s1
InChIKeyDUWKDCCNQXUUSS-NXEZZACHSA-N
MW195.26 g/mol
LogP2.23
Rot. Bonds2

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

(4R,5R)-4-cyclohexyl-5-ethenyl-1,3-oxazolidin-2-one (PubChem CID 134966187) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is (4R,5R)-4-cyclohexyl-5-ethenyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4R,5R)-4-cyclohexyl-5-ethenyl-1,3-oxazolidin-2-one
PubChem CID134966187
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name(4R,5R)-4-cyclohexyl-5-ethenyl-1,3-oxazolidin-2-one
SMILESC=C[C@H]1OC(=O)N[C@@H]1C1CCCCC1
InChIInChI=1S/C11H17NO2/c1-2-9-10(12-11(13)14-9)8-6-4-3-5-7-8/h2,8-10H,1,3-7H2,(H,12,13)/t9-,10-/m1/s1
InChIKeyDUWKDCCNQXUUSS-NXEZZACHSA-N
XLogP2.23
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 52.23
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 (4R,5R)-4-cyclohexyl-5-ethenyl-1,3-oxazolidin-2-one?
The IUPAC name of (4R,5R)-4-cyclohexyl-5-ethenyl-1,3-oxazolidin-2-one (CID 134966187) is (4R,5R)-4-cyclohexyl-5-ethenyl-1,3-oxazolidin-2-one.
What is the SMILES notation for (4R,5R)-4-cyclohexyl-5-ethenyl-1,3-oxazolidin-2-one?
The canonical SMILES for (4R,5R)-4-cyclohexyl-5-ethenyl-1,3-oxazolidin-2-one is C=C[C@H]1OC(=O)N[C@@H]1C1CCCCC1.
What is the InChIKey of (4R,5R)-4-cyclohexyl-5-ethenyl-1,3-oxazolidin-2-one?
The InChIKey is DUWKDCCNQXUUSS-NXEZZACHSA-N. The full InChI is InChI=1S/C11H17NO2/c1-2-9-10(12-11(13)14-9)8-6-4-3-5-7-8/h2,8-10H,1,3-7H2,(H,12,13)/t9-,10-/m1/s1.
What are the key properties of (4R,5R)-4-cyclohexyl-5-ethenyl-1,3-oxazolidin-2-one?
(4R,5R)-4-cyclohexyl-5-ethenyl-1,3-oxazolidin-2-one has a molecular weight of 195.26 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5R)-4-cyclohexyl-5-ethenyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 134966187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).