3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one

C11H19NO2 — CID 12597417

IUPAC3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one
SMILESCC1(C)CN(C2CCCCC2)C(=O)O1
InChIInChI=1S/C11H19NO2/c1-11(2)8-12(10(13)14-11)9-6-4-3-5-7-9/h9H,3-8H2,1-2H3
InChIKeyPLJVRIJWUZMLFD-UHFFFAOYSA-N
MW197.28 g/mol
LogP2.55
Rot. Bonds1

About 3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one

3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one (PubChem CID 12597417) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one
PubChem CID12597417
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one
SMILESCC1(C)CN(C2CCCCC2)C(=O)O1
InChIInChI=1S/C11H19NO2/c1-11(2)8-12(10(13)14-11)9-6-4-3-5-7-9/h9H,3-8H2,1-2H3
InChIKeyPLJVRIJWUZMLFD-UHFFFAOYSA-N
XLogP2.55
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one?
The IUPAC name of 3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one (CID 12597417) is 3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one?
The canonical SMILES for 3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one is CC1(C)CN(C2CCCCC2)C(=O)O1.
What is the InChIKey of 3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one?
The InChIKey is PLJVRIJWUZMLFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-11(2)8-12(10(13)14-11)9-6-4-3-5-7-9/h9H,3-8H2,1-2H3.
What are the key properties of 3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one?
3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one has a molecular weight of 197.28 g/mol, XLogP of 2.55, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-5,5-dimethyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 12597417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).