4-cyclohexyl-4-methyl-1,3-oxazinan-2-one

C11H19NO2 — CID 105450803

IUPAC4-cyclohexyl-4-methyl-1,3-oxazinan-2-one
SMILESCC1(C2CCCCC2)CCOC(=O)N1
InChIInChI=1S/C11H19NO2/c1-11(7-8-14-10(13)12-11)9-5-3-2-4-6-9/h9H,2-8H2,1H3,(H,12,13)
InChIKeyNEUBSPATJHUGQI-UHFFFAOYSA-N
MW197.28 g/mol
LogP2.46
Rot. Bonds1

About 4-cyclohexyl-4-methyl-1,3-oxazinan-2-one

4-cyclohexyl-4-methyl-1,3-oxazinan-2-one (PubChem CID 105450803) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 4-cyclohexyl-4-methyl-1,3-oxazinan-2-one.

Molecular Properties

Compound Name4-cyclohexyl-4-methyl-1,3-oxazinan-2-one
PubChem CID105450803
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name4-cyclohexyl-4-methyl-1,3-oxazinan-2-one
SMILESCC1(C2CCCCC2)CCOC(=O)N1
InChIInChI=1S/C11H19NO2/c1-11(7-8-14-10(13)12-11)9-5-3-2-4-6-9/h9H,2-8H2,1H3,(H,12,13)
InChIKeyNEUBSPATJHUGQI-UHFFFAOYSA-N
XLogP2.46
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4S,4aR,8aS)-8a-methyl-4-propan-2-yl-4,4a,5,6,7,8-hexahydro-1H-benzo[d][1,3]oxazin-2-one
CID 15481138
(4aS,7R,8aR)-4,4,7-trimethyl-4a,5,6,7,8,8a-hexahydro-3H-benzo[e][1,3]oxazin-2-one
CID 162410546
(4S,6S)-4-cyclohexyl-6-(2-methylpropyl)-1,3-oxazinan-2-one
CID 101155621
(2-ethyl-2,5-dimethyl-1-azaspiro[5.5]undecan-4-yl) N-methylcarbamate
CID 21330468
ethyl N-(1-cyclohexylcyclohexyl)carbamate
CID 53766656
8a-methyl-4,4a,5,6,7,8-hexahydro-1H-benzo[d][1,3]oxazin-2-one
CID 59871613
Octadecyl carbamate;2,2,4,6,6-pentamethylpiperidine
CID 67933713
3-(2,2,6,6-Tetramethylpiperidin-4-yl)propyl carbamate
CID 69130789
1,3,3-Trimethyl-7-oxa-5-azaspiro[3.5]nonan-6-one
CID 139294337
butyl N-[2-(3-methylcyclohexyl)propan-2-yl]carbamate
CID 140417841
4,4,9-Trimethyl-3-oxa-1-azaspiro[5.5]undecan-2-one
CID 145416269
2-methylpropyl N-[2-(3-methylcyclohexyl)propan-2-yl]carbamate
CID 145813538

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-4-methyl-1,3-oxazinan-2-one?
The IUPAC name of 4-cyclohexyl-4-methyl-1,3-oxazinan-2-one (CID 105450803) is 4-cyclohexyl-4-methyl-1,3-oxazinan-2-one.
What is the SMILES notation for 4-cyclohexyl-4-methyl-1,3-oxazinan-2-one?
The canonical SMILES for 4-cyclohexyl-4-methyl-1,3-oxazinan-2-one is CC1(C2CCCCC2)CCOC(=O)N1.
What is the InChIKey of 4-cyclohexyl-4-methyl-1,3-oxazinan-2-one?
The InChIKey is NEUBSPATJHUGQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-11(7-8-14-10(13)12-11)9-5-3-2-4-6-9/h9H,2-8H2,1H3,(H,12,13).
What are the key properties of 4-cyclohexyl-4-methyl-1,3-oxazinan-2-one?
4-cyclohexyl-4-methyl-1,3-oxazinan-2-one has a molecular weight of 197.28 g/mol, XLogP of 2.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-4-methyl-1,3-oxazinan-2-one is sourced from PubChem (CID 105450803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).