4-ethyl-6-methyl-1,3-oxazinan-2-one

C7H13NO2 — CID 123927031

IUPAC4-ethyl-6-methyl-1,3-oxazinan-2-one
SMILESCCC1CC(C)OC(=O)N1
InChIInChI=1S/C7H13NO2/c1-3-6-4-5(2)10-7(9)8-6/h5-6H,3-4H2,1-2H3,(H,8,9)
InChIKeyPQEIFGBXRXMKQL-UHFFFAOYSA-N
MW143.19 g/mol
LogP1.28
Rot. Bonds1

About 4-ethyl-6-methyl-1,3-oxazinan-2-one

4-ethyl-6-methyl-1,3-oxazinan-2-one (PubChem CID 123927031) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is 4-ethyl-6-methyl-1,3-oxazinan-2-one.

Molecular Properties

Compound Name4-ethyl-6-methyl-1,3-oxazinan-2-one
PubChem CID123927031
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name4-ethyl-6-methyl-1,3-oxazinan-2-one
SMILESCCC1CC(C)OC(=O)N1
InChIInChI=1S/C7H13NO2/c1-3-6-4-5(2)10-7(9)8-6/h5-6H,3-4H2,1-2H3,(H,8,9)
InChIKeyPQEIFGBXRXMKQL-UHFFFAOYSA-N
XLogP1.28
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-6-methyl-1,3-oxazinan-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-Methyl-1,3-oxazinan-2-one
CID 351208
(4R)-4-methyl-1,3-oxazinan-2-one
CID 118600767
(4S)-4-methyl-1,3-oxazinan-2-one
CID 177801697
(4R)-4-[(1S)-1-fluoropropyl]-1,3-oxazinan-2-one
CID 134968378
(4R)-4-[(1S)-1-hydroxypropyl]-1,3-oxazinan-2-one
CID 11600713
(4R)-4-propyl-1,3-oxazinan-2-one
CID 162410725
(4R)-4-ethyl-1,3-oxazinan-2-one
CID 162410726
2,2,2-trifluoroethyl N-(2-methyloxan-4-yl)carbamate
CID 103887484
6-Pentyl-1,3-oxazinan-2-one
CID 85528985
4-Methyl-1,3-oxazinan-2-one
CID 12202794
Piperidin-4-yl isopropylcarbamate
CID 20735409
propan-2-yl N-(oxan-4-yl)carbamate
CID 58469300

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-methyl-1,3-oxazinan-2-one?
The IUPAC name of 4-ethyl-6-methyl-1,3-oxazinan-2-one (CID 123927031) is 4-ethyl-6-methyl-1,3-oxazinan-2-one.
What is the SMILES notation for 4-ethyl-6-methyl-1,3-oxazinan-2-one?
The canonical SMILES for 4-ethyl-6-methyl-1,3-oxazinan-2-one is CCC1CC(C)OC(=O)N1.
What is the InChIKey of 4-ethyl-6-methyl-1,3-oxazinan-2-one?
The InChIKey is PQEIFGBXRXMKQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-3-6-4-5(2)10-7(9)8-6/h5-6H,3-4H2,1-2H3,(H,8,9).
What are the key properties of 4-ethyl-6-methyl-1,3-oxazinan-2-one?
4-ethyl-6-methyl-1,3-oxazinan-2-one has a molecular weight of 143.19 g/mol, XLogP of 1.28, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-methyl-1,3-oxazinan-2-one is sourced from PubChem (CID 123927031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).