4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one

C16H21NO2 — CID 142507215

IUPAC4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one
SMILESCN1C(=O)OC(c2ccccc2)C1C1CCCCC1
InChIInChI=1S/C16H21NO2/c1-17-14(12-8-4-2-5-9-12)15(19-16(17)18)13-10-6-3-7-11-13/h3,6-7,10-12,14-15H,2,4-5,8-9H2,1H3
InChIKeyFTTIXTIHZYJMGL-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.76
Rot. Bonds2

About 4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one

4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one (PubChem CID 142507215) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is 4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one
PubChem CID142507215
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC Name4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one
SMILESCN1C(=O)OC(c2ccccc2)C1C1CCCCC1
InChIInChI=1S/C16H21NO2/c1-17-14(12-8-4-2-5-9-12)15(19-16(17)18)13-10-6-3-7-11-13/h3,6-7,10-12,14-15H,2,4-5,8-9H2,1H3
InChIKeyFTTIXTIHZYJMGL-UHFFFAOYSA-N
XLogP3.76
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidin-2-one
CID 58484806
(5R,6S)-3-cyclohexyl-5-methyl-6-phenylmorpholin-2-one
CID 102533542
(3R,4S)-4-cyclohexyl-1,3-diphenylazetidin-2-one
CID 102205609
3-cyclohexyl-5-methyl-4-phenyl-1,3-oxazolidin-2-one
CID 123354245
N-cyclohexyl-4-methyl-2-oxo-5-phenyl-1,3-oxazolidine-3-carboxamide
CID 11066603
(2R,3S,4S)-2-cyclohexyl-3-methyl-4-phenyloxetane
CID 100996137
(1R,4R)-2-methyl-1-phenyl-5-oxa-2-azaspiro[3.4]octan-3-one
CID 101180553
3-methyl-6-phenyl-3a,4,8,8a-tetrahydro-[1,3]dioxepino[5,6-d][1,3]oxazol-2-one
CID 86168080
4-methyl-5-phenyl-3-propyl-1,3-oxazolidin-2-one
CID 19370117
(2R,3R)-3,4-dimethyl-2-phenyl-1,4-oxazepane-5,7-dione
CID 22216391
4-methyl-2-oxo-5-phenyl-1,3-oxazolidine-3-carboxamide
CID 57349112
(3R,3aR,7aS)-3-phenyl-3a,4,5,6,7,7a-hexahydro-3H-2-benzofuran-1-one
CID 13148720

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one?
The IUPAC name of 4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one (CID 142507215) is 4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one?
The canonical SMILES for 4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one is CN1C(=O)OC(c2ccccc2)C1C1CCCCC1.
What is the InChIKey of 4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one?
The InChIKey is FTTIXTIHZYJMGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO2/c1-17-14(12-8-4-2-5-9-12)15(19-16(17)18)13-10-6-3-7-11-13/h3,6-7,10-12,14-15H,2,4-5,8-9H2,1H3.
What are the key properties of 4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one?
4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one has a molecular weight of 259.35 g/mol, XLogP of 3.76, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-3-methyl-5-phenyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 142507215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).