N-(3-acetylphenyl)morpholine-4-carboxamide

C13H16N2O3 — CID 671267

IUPACN-(3-acetylphenyl)morpholine-4-carboxamide
SMILESCC(=O)c1cccc(NC(=O)N2CCOCC2)c1
InChIInChI=1S/C13H16N2O3/c1-10(16)11-3-2-4-12(9-11)14-13(17)15-5-7-18-8-6-15/h2-4,9H,5-8H2,1H3,(H,14,17)
InChIKeyGFGGXIIHWJXKMZ-UHFFFAOYSA-N
MW248.28 g/mol
LogP1.75
Rot. Bonds2

About N-(3-acetylphenyl)morpholine-4-carboxamide

N-(3-acetylphenyl)morpholine-4-carboxamide (PubChem CID 671267) has the molecular formula C13H16N2O3 and a molecular weight of 248.28 g/mol. Its IUPAC name is N-(3-acetylphenyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)morpholine-4-carboxamide
PubChem CID671267
Molecular FormulaC13H16N2O3
Molecular Weight248.28 g/mol
Exact Mass248.12
IUPAC NameN-(3-acetylphenyl)morpholine-4-carboxamide
SMILESCC(=O)c1cccc(NC(=O)N2CCOCC2)c1
InChIInChI=1S/C13H16N2O3/c1-10(16)11-3-2-4-12(9-11)14-13(17)15-5-7-18-8-6-15/h2-4,9H,5-8H2,1H3,(H,14,17)
InChIKeyGFGGXIIHWJXKMZ-UHFFFAOYSA-N
XLogP1.75
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-acetylphenyl)morpholine-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

3-(3-acetylphenyl)-1-[3-[(2R,4S)-2-[(1S)-1-hydroxypropyl]-4-(phenylmethyl)piperidin-1-yl]propyl]urea
CID 9868459
4-(4-acetylphenyl)-N-(4-methylphenyl)piperazine-1-carboxamide
CID 16012840
N-(3-Acetylphenyl)-N'-phenylurea
CID 295256
N-(2-morpholin-4-ylethyl)-4-(pentanoylamino)benzamide
CID 2212314
N1-phenyl-4-benzoylpiperidine-1-carboxamide
CID 2740754
3-(Morpholine-4-carbonyl)aniline
CID 6485064
4'-Morpholinopropiophenone
CID 268475
4-[(2,6-Dimethylmorpholin-4-yl)carbonyl]aniline
CID 577562
1-(3-Acetyl-phenyl)-3-{3-[(2R,4S)-4-benzyl-2-((S)-1-hydroxy-pentyl)-piperidin-1-yl]-propyl}-urea
CID 44295536
N-(2-carbamoylphenyl)morpholine-4-carboxamide
CID 788807
N-(3-acetylphenyl)azepane-1-carboxamide
CID 970026
1-(4-Acetylphenyl)-3-(3-morpholin-4-ylpropyl)thiourea
CID 2037527

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)morpholine-4-carboxamide?
The IUPAC name of N-(3-acetylphenyl)morpholine-4-carboxamide (CID 671267) is N-(3-acetylphenyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)morpholine-4-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)morpholine-4-carboxamide is CC(=O)c1cccc(NC(=O)N2CCOCC2)c1.
What is the InChIKey of N-(3-acetylphenyl)morpholine-4-carboxamide?
The InChIKey is GFGGXIIHWJXKMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O3/c1-10(16)11-3-2-4-12(9-11)14-13(17)15-5-7-18-8-6-15/h2-4,9H,5-8H2,1H3,(H,14,17).
What are the key properties of N-(3-acetylphenyl)morpholine-4-carboxamide?
N-(3-acetylphenyl)morpholine-4-carboxamide has a molecular weight of 248.28 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)morpholine-4-carboxamide is sourced from PubChem (CID 671267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).