5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one

C17H18N2O3 — CID 95583766

IUPAC5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one
SMILESC[C@H]1CN(C(=O)c2ccc(=O)[nH]c2)C[C@H](c2ccccc2)O1
InChIInChI=1S/C17H18N2O3/c1-12-10-19(17(21)14-7-8-16(20)18-9-14)11-15(22-12)13-5-3-2-4-6-13/h2-9,12,15H,10-11H2,1H3,(H,18,20)/t12-,15+/m0/s1
InChIKeyXWIAUEWOOVPNFS-SWLSCSKDSA-N
MW298.34 g/mol
LogP1.98
Rot. Bonds2

About 5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one

5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one (PubChem CID 95583766) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is 5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one
PubChem CID95583766
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC Name5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one
SMILESC[C@H]1CN(C(=O)c2ccc(=O)[nH]c2)C[C@H](c2ccccc2)O1
InChIInChI=1S/C17H18N2O3/c1-12-10-19(17(21)14-7-8-16(20)18-9-14)11-15(22-12)13-5-3-2-4-6-13/h2-9,12,15H,10-11H2,1H3,(H,18,20)/t12-,15+/m0/s1
InChIKeyXWIAUEWOOVPNFS-SWLSCSKDSA-N
XLogP1.98
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-methyl-6-phenylmorpholine-4-carbonyl)-1H-pyridin-2-one
CID 47914673
(2-methyl-6-phenylmorpholin-4-yl)-phenylmethanone
CID 47914795
3-[(2R,6R)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridazin-6-one
CID 94823289
5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]pyridine-2-carboxylic acid
CID 124692496
5-[(2R,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]pyridine-2-carboxylic acid
CID 124694837
5-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-2-carboxylic acid
CID 122158408
2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid
CID 122055413
(2-methyl-6-phenylmorpholin-4-yl)-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)methanone
CID 47914996
[4-(2-methyl-6-phenylmorpholine-4-carbonyl)phenyl]methylurea
CID 47914258
4-[(2R,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-quinolin-2-one
CID 52528403
(2-methyl-6-phenylmorpholin-4-yl)-pyrazin-2-ylmethanone
CID 47914748
[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone
CID 94823256

Frequently Asked Questions

What is the IUPAC name of 5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one?
The IUPAC name of 5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one (CID 95583766) is 5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one.
What is the SMILES notation for 5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one?
The canonical SMILES for 5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one is C[C@H]1CN(C(=O)c2ccc(=O)[nH]c2)C[C@H](c2ccccc2)O1.
What is the InChIKey of 5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one?
The InChIKey is XWIAUEWOOVPNFS-SWLSCSKDSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-12-10-19(17(21)14-7-8-16(20)18-9-14)11-15(22-12)13-5-3-2-4-6-13/h2-9,12,15H,10-11H2,1H3,(H,18,20)/t12-,15+/m0/s1.
What are the key properties of 5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one?
5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one has a molecular weight of 298.34 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one is sourced from PubChem (CID 95583766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).