1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one

C13H22N2O4 — CID 45242060

IUPAC1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one
SMILESCOCCN1CC(C(=O)N2CCCCO2)CCC1=O
InChIInChI=1S/C13H22N2O4/c1-18-9-7-14-10-11(4-5-12(14)16)13(17)15-6-2-3-8-19-15/h11H,2-10H2,1H3
InChIKeyCXHNTKDCRATALP-UHFFFAOYSA-N
MW270.33 g/mol
LogP0.43
Rot. Bonds4

About 1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one

1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one (PubChem CID 45242060) has the molecular formula C13H22N2O4 and a molecular weight of 270.33 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one.

Molecular Properties

Compound Name1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one
PubChem CID45242060
Molecular FormulaC13H22N2O4
Molecular Weight270.33 g/mol
Exact Mass270.16
IUPAC Name1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one
SMILESCOCCN1CC(C(=O)N2CCCCO2)CCC1=O
InChIInChI=1S/C13H22N2O4/c1-18-9-7-14-10-11(4-5-12(14)16)13(17)15-6-2-3-8-19-15/h11H,2-10H2,1H3
InChIKeyCXHNTKDCRATALP-UHFFFAOYSA-N
XLogP0.43
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 50.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 1-(2-methoxyethyl)-6-oxopiperidine-3-carboxylate
CID 102569899
4-[1-(2-methoxyethyl)-6-oxopiperidine-3-carbonyl]-1-propylpiperazin-2-one
CID 131918848
(5R)-1-[(3-fluorophenyl)methyl]-5-(1,2-oxazolidine-2-carbonyl)piperidin-2-one
CID 25375387
1-cycloheptyl-5-(1,2-oxazolidine-2-carbonyl)piperidin-2-one
CID 45189435
5-[4-(2,6-dimethyl-4-pyridinyl)piperazine-1-carbonyl]-1-(2-methoxyethyl)piperidin-2-one
CID 45192162
(3S)-N-[(1-hydroxycyclohexyl)methyl]-1-(2-methoxyethyl)-6-oxopiperidine-3-carboxamide
CID 25293036
(4R)-1-(2-methoxyethyl)-4-[(3S)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one
CID 94046017
[(3aS,7S,7aS)-2-(2-methoxyethyl)-3,3a,4,6,7,7a-hexahydro-1H-pyrano[3,4-c]pyrrol-7-yl]-(oxazinan-2-yl)methanone
CID 133141616
N-[(1-benzylpiperidin-4-yl)methyl]-1-(2-methoxyethyl)-6-oxopiperidine-3-carboxamide
CID 45248237
(3S)-N-[(1-benzylpiperidin-4-yl)methyl]-1-(2-methoxyethyl)-6-oxopiperidine-3-carboxamide
CID 26399073
1-(2-methoxyethyl)-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide
CID 45208370
(3R)-1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxylate
CID 7061674

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one?
The IUPAC name of 1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one (CID 45242060) is 1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one.
What is the SMILES notation for 1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one?
The canonical SMILES for 1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one is COCCN1CC(C(=O)N2CCCCO2)CCC1=O.
What is the InChIKey of 1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one?
The InChIKey is CXHNTKDCRATALP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O4/c1-18-9-7-14-10-11(4-5-12(14)16)13(17)15-6-2-3-8-19-15/h11H,2-10H2,1H3.
What are the key properties of 1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one?
1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one has a molecular weight of 270.33 g/mol, XLogP of 0.43, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-5-(oxazinane-2-carbonyl)piperidin-2-one is sourced from PubChem (CID 45242060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).