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

C10H17NO2 — CID 44558834

IUPAC5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one
SMILESCC1NC(=O)OC1C1CCCCC1
InChIInChI=1S/C10H17NO2/c1-7-9(13-10(12)11-7)8-5-3-2-4-6-8/h7-9H,2-6H2,1H3,(H,11,12)
InChIKeyYGQBSMBHRDHGPJ-UHFFFAOYSA-N
MW183.25 g/mol
LogP2.06
Rot. Bonds1

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

5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one (PubChem CID 44558834) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one
PubChem CID44558834
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one
SMILESCC1NC(=O)OC1C1CCCCC1
InChIInChI=1S/C10H17NO2/c1-7-9(13-10(12)11-7)8-5-3-2-4-6-8/h7-9H,2-6H2,1H3,(H,11,12)
InChIKeyYGQBSMBHRDHGPJ-UHFFFAOYSA-N
XLogP2.06
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4S,5R)-5-cyclohexyl-2-oxo-1,3-oxazolidine-4-carboxylic acid
CID 15698620
(3S,4R)-4-cyclohexyl-3-methyloxetan-2-one
CID 11275238
(4S,5R)-5-cyclohexyl-4-(1-iodoethenyl)-1,3-oxazolidin-2-one
CID 15698611
(4R,5S,6R)-4,5,6-trimethyl-1,3-oxazinan-2-one
CID 23246426
5-hydroxy-4-methyl-1,3-oxazolidin-2-one
CID 89199038
[(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane
CID 72735701
5-cyclohexyl-4-methylpyrrolidin-2-one
CID 155214705
(2S,3R)-2-cyclohexyl-3-methyl-2,3-dihydropyran-4-one
CID 10821644
(4aS,9aS)-4,4a,5,6,7,8,9,9a-octahydro-3H-cyclohepta[e][1,3]oxazin-2-one
CID 131027015
4,5-dicyclohexyl-2-propan-2-ylidene-1,3-dioxolane
CID 174373573
(4S,5S)-4,5-dicyclohexyl-2-methyl-1,3,2-dioxaborolane
CID 10354715
(3aR,7aS)-7-methyl-3a,4,5,6,7,7a-hexahydro-3H-[1,3]oxazolo[4,5-c]pyridin-2-one
CID 69029227

Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one?
The IUPAC name of 5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one (CID 44558834) is 5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one?
The canonical SMILES for 5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one is CC1NC(=O)OC1C1CCCCC1.
What is the InChIKey of 5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one?
The InChIKey is YGQBSMBHRDHGPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-7-9(13-10(12)11-7)8-5-3-2-4-6-8/h7-9H,2-6H2,1H3,(H,11,12).
What are the key properties of 5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one?
5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one has a molecular weight of 183.25 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 44558834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).