3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one

C14H22N2O2 — CID 178002545

IUPAC3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one
SMILESCCC1(CC)OCCN(c2ccc[nH]c2=O)[C@H]1C
InChIInChI=1S/C14H22N2O2/c1-4-14(5-2)11(3)16(9-10-18-14)12-7-6-8-15-13(12)17/h6-8,11H,4-5,9-10H2,1-3H3,(H,15,17)/t11-/m0/s1
InChIKeyGPSIDNMJYWUQEN-NSHDSACASA-N
MW250.34 g/mol
LogP2.16
Rot. Bonds3

About 3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one

3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one (PubChem CID 178002545) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one.

Molecular Properties

Compound Name3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one
PubChem CID178002545
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one
SMILESCCC1(CC)OCCN(c2ccc[nH]c2=O)[C@H]1C
InChIInChI=1S/C14H22N2O2/c1-4-14(5-2)11(3)16(9-10-18-14)12-7-6-8-15-13(12)17/h6-8,11H,4-5,9-10H2,1-3H3,(H,15,17)/t11-/m0/s1
InChIKeyGPSIDNMJYWUQEN-NSHDSACASA-N
XLogP2.16
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylbutyl)-2-(4-morpholin-4-yl-2-oxo-1-pyridinyl)acetamide
CID 90655131
N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-6-oxo-1H-pyridine-2-carboxamide
CID 132360567
N-[[1-(2,2-dimethylmorpholin-4-yl)cyclohexyl]methyl]-1-methyl-6-oxopyridine-2-carboxamide
CID 136517955
2-(2,6-dimethylmorpholin-4-yl)-3-methyl-N-(6-oxo-1-propyl-3-pyridinyl)butanamide
CID 51094925
3-morpholin-4-yl-1H-pyridin-2-one
CID 68885060
3-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)-1H-pyridin-2-one
CID 134394542
tert-butyl 4-(2-oxo-1H-pyridin-3-yl)-1-oxa-4,9-diazaspiro[5.5]undecane-9-carboxylate
CID 134394545
3-(Methylamino)-1-(4-morpholin-4-ylcyclohexyl)pyridin-2-one
CID 137449072
1-[(3R)-oxan-3-yl]-3-(propan-2-ylamino)pyridin-2-one
CID 137449085
3-(Methylamino)-1-(oxan-3-yl)pyridin-2-one
CID 137449426
N-[1,2-Dihydro-2-oxo-1-(tetrahydro-2H-pyran-3-yl)-3-pyridinyl]acetamide
CID 137450779
3-(methylamino)-1-[(3S)-oxan-3-yl]pyridin-2-one
CID 139373545

Frequently Asked Questions

What is the IUPAC name of 3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one?
The IUPAC name of 3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one (CID 178002545) is 3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one.
What is the SMILES notation for 3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one?
The canonical SMILES for 3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one is CCC1(CC)OCCN(c2ccc[nH]c2=O)[C@H]1C.
What is the InChIKey of 3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one?
The InChIKey is GPSIDNMJYWUQEN-NSHDSACASA-N. The full InChI is InChI=1S/C14H22N2O2/c1-4-14(5-2)11(3)16(9-10-18-14)12-7-6-8-15-13(12)17/h6-8,11H,4-5,9-10H2,1-3H3,(H,15,17)/t11-/m0/s1.
What are the key properties of 3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one?
3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one has a molecular weight of 250.34 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3S)-2,2-diethyl-3-methylmorpholin-4-yl]-1H-pyridin-2-one is sourced from PubChem (CID 178002545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).