4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide

C20H22N2O3 — CID 71687662

IUPAC4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide
SMILESCC(NC(=O)C1OCC(=O)N(C)C1c1ccccc1)c1ccccc1
InChIInChI=1S/C20H22N2O3/c1-14(15-9-5-3-6-10-15)21-20(24)19-18(16-11-7-4-8-12-16)22(2)17(23)13-25-19/h3-12,14,18-19H,13H2,1-2H3,(H,21,24)
InChIKeyYSMQOAQYSZBOKO-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.46
Rot. Bonds4

About 4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide

4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide (PubChem CID 71687662) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is 4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide.

Molecular Properties

Compound Name4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide
PubChem CID71687662
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC Name4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide
SMILESCC(NC(=O)C1OCC(=O)N(C)C1c1ccccc1)c1ccccc1
InChIInChI=1S/C20H22N2O3/c1-14(15-9-5-3-6-10-15)21-20(24)19-18(16-11-7-4-8-12-16)22(2)17(23)13-25-19/h3-12,14,18-19H,13H2,1-2H3,(H,21,24)
InChIKeyYSMQOAQYSZBOKO-UHFFFAOYSA-N
XLogP2.46
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,3R)-N-[(2S)-butan-2-yl]-4-methyl-5-oxo-3-phenylmorpholine-2-carboxamide
CID 98768943
(2S,3R)-N-cyclopentyl-4-methyl-5-oxo-3-phenylmorpholine-2-carboxamide
CID 95738078
(2R,3S)-3-(4-chlorophenyl)-4-methyl-5-oxo-N-propan-2-ylmorpholine-2-carboxamide
CID 95739579
(2S,3S)-3-(4-chlorophenyl)-4-methyl-5-oxo-N-propan-2-ylmorpholine-2-carboxamide
CID 95739578
(2S,3S)-N-(cyclopentylmethyl)-4-methyl-5-oxo-3-phenylmorpholine-2-carboxamide
CID 95738039
(2S,3S)-4-methyl-5-oxo-N-[[(2R)-oxolan-2-yl]methyl]-3-phenylmorpholine-2-carboxamide
CID 100802698
N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-4-methyl-5-oxo-3-phenylmorpholine-2-carboxamide
CID 110278553
(2R,3S)-N-(3-fluorophenyl)-4-methyl-5-oxo-3-phenylmorpholine-2-carboxamide
CID 95738065
(5S,6S)-4-methyl-6-(4-methylpiperazine-1-carbonyl)-5-phenylmorpholin-3-one
CID 95738127
N-(4,5-dimethyl-1,3-thiazol-2-yl)-4-methyl-5-oxo-3-phenylmorpholine-2-carboxamide
CID 56730597
4-methyl-5-oxo-N-(3-phenoxypropyl)-3-phenylmorpholine-2-carboxamide
CID 119039713
(2S,3R)-N-tert-butyl-5-oxo-3-phenyl-4-propan-2-ylmorpholine-2-carboxamide
CID 134695849

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide?
The IUPAC name of 4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide (CID 71687662) is 4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide.
What is the SMILES notation for 4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide?
The canonical SMILES for 4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide is CC(NC(=O)C1OCC(=O)N(C)C1c1ccccc1)c1ccccc1.
What is the InChIKey of 4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide?
The InChIKey is YSMQOAQYSZBOKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-14(15-9-5-3-6-10-15)21-20(24)19-18(16-11-7-4-8-12-16)22(2)17(23)13-25-19/h3-12,14,18-19H,13H2,1-2H3,(H,21,24).
What are the key properties of 4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide?
4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-oxo-3-phenyl-N-(1-phenylethyl)morpholine-2-carboxamide is sourced from PubChem (CID 71687662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).