N-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide

C14H19N3O3 — CID 47041767

IUPACN-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide
SMILESCC(=O)Nc1ccc(C)c(NC(=O)N2CCOCC2)c1
InChIInChI=1S/C14H19N3O3/c1-10-3-4-12(15-11(2)18)9-13(10)16-14(19)17-5-7-20-8-6-17/h3-4,9H,5-8H2,1-2H3,(H,15,18)(H,16,19)
InChIKeyKPEDJXPFFIIDMV-UHFFFAOYSA-N
MW277.32 g/mol
LogP1.82
Rot. Bonds2

About N-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide

N-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide (PubChem CID 47041767) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is N-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide
PubChem CID47041767
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC NameN-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide
SMILESCC(=O)Nc1ccc(C)c(NC(=O)N2CCOCC2)c1
InChIInChI=1S/C14H19N3O3/c1-10-3-4-12(15-11(2)18)9-13(10)16-14(19)17-5-7-20-8-6-17/h3-4,9H,5-8H2,1-2H3,(H,15,18)(H,16,19)
InChIKeyKPEDJXPFFIIDMV-UHFFFAOYSA-N
XLogP1.82
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-acetamido-2-methylphenyl)-4-morpholin-4-ylsulfonylpiperazine-1-carboxamide
CID 55742297
(2S)-N-(5-acetamido-2-methylphenyl)-2-methylmorpholine-4-carboxamide
CID 94176614
N-(5-fluoro-2-methylphenyl)morpholine-4-carboxamide
CID 3250588
N-(5-acetamido-2-methylphenyl)-4-pyridin-4-ylpiperazine-1-carboxamide
CID 86994575
N-(3-acetamidophenyl)morpholine-4-carboxamide
CID 3707113
(2R)-N-(3-acetamido-4-methylphenyl)-2-methylmorpholine-4-carboxamide
CID 94183755
4-hydroxy-N-[3-[(4-hydroxypiperidine-1-carbonyl)amino]-4-methylphenyl]piperidine-1-carboxamide
CID 41296153
N-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide
CID 78993692
N-[5-(cyclopropylcarbamoyl)-2-methylphenyl]morpholine-4-carboxamide
CID 51081890
N-(4-methoxy-3-methylphenyl)morpholine-4-carboxamide
CID 47322511
4-(4-fluorophenyl)-N-[3-[[4-(4-fluorophenyl)piperazine-1-carbonyl]amino]-4-methylphenyl]piperazine-1-carboxamide
CID 4087050
N-[5-(3-aminoprop-1-ynyl)-2-methylphenyl]morpholine-4-carboxamide
CID 79151985

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide?
The IUPAC name of N-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide (CID 47041767) is N-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide?
The canonical SMILES for N-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide is CC(=O)Nc1ccc(C)c(NC(=O)N2CCOCC2)c1.
What is the InChIKey of N-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide?
The InChIKey is KPEDJXPFFIIDMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-10-3-4-12(15-11(2)18)9-13(10)16-14(19)17-5-7-20-8-6-17/h3-4,9H,5-8H2,1-2H3,(H,15,18)(H,16,19).
What are the key properties of N-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide?
N-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide has a molecular weight of 277.32 g/mol, XLogP of 1.82, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methylphenyl)morpholine-4-carboxamide is sourced from PubChem (CID 47041767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).