N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide

C15H20N2O3 — CID 61345863

IUPACN-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide
SMILESCC(=O)c1cccc(NC(=O)N2CC(C)OCC2C)c1
InChIInChI=1S/C15H20N2O3/c1-10-9-20-11(2)8-17(10)15(19)16-14-6-4-5-13(7-14)12(3)18/h4-7,10-11H,8-9H2,1-3H3,(H,16,19)
InChIKeyPNONTAFBBOQRFG-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.53
Rot. Bonds2

About N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide

N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide (PubChem CID 61345863) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide
PubChem CID61345863
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide
SMILESCC(=O)c1cccc(NC(=O)N2CC(C)OCC2C)c1
InChIInChI=1S/C15H20N2O3/c1-10-9-20-11(2)8-17(10)15(19)16-14-6-4-5-13(7-14)12(3)18/h4-7,10-11H,8-9H2,1-3H3,(H,16,19)
InChIKeyPNONTAFBBOQRFG-UHFFFAOYSA-N
XLogP2.53
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide 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

(2S,6S)-N-(3-acetylphenyl)-2,6-dimethylmorpholine-4-carboxamide
CID 969916
(3-bromophenyl)-(2,5-dimethylmorpholin-4-yl)methanone
CID 43420926
N-(3-chlorophenyl)-5-methyl-2-phenylmorpholine-4-carboxamide
CID 110369345
N-(3-acetylphenyl)-3-hydroxy-4-methylpiperidine-1-carboxamide
CID 103896288
(2,5-dimethylmorpholin-4-yl)-(3-iodophenyl)methanone
CID 47163087
N-(3-acetylphenyl)-2,3-dimethylpiperidine-1-carboxamide
CID 62124695
(2S,4R)-1-[(3-acetylphenyl)carbamoyl]-4-hydroxypyrrolidine-2-carboxylic acid
CID 63843514
(2R,4R)-1-[(3-acetylphenyl)carbamoyl]-4-hydroxypyrrolidine-2-carboxylic acid
CID 79000304
1-[(3-acetylphenyl)carbamoyl]-3-methylpyrrolidine-2-carboxylic acid
CID 102776316
N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide
CID 55831038
N-(3-acetylphenyl)-3-azatricyclo[4.2.1.02,5]nonane-3-carboxamide
CID 86768699
methyl 3-[[4-[(2,5-dimethylmorpholine-4-carbonyl)amino]benzoyl]amino]propanoate
CID 154751575

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide (CID 61345863) is N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide is CC(=O)c1cccc(NC(=O)N2CC(C)OCC2C)c1.
What is the InChIKey of N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide?
The InChIKey is PNONTAFBBOQRFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-10-9-20-11(2)8-17(10)15(19)16-14-6-4-5-13(7-14)12(3)18/h4-7,10-11H,8-9H2,1-3H3,(H,16,19).
What are the key properties of N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide?
N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide is sourced from PubChem (CID 61345863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).