N-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide

C13H15N3O4 — CID 110650578

IUPACN-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)C2COC(=O)N2C)cc1
InChIInChI=1S/C13H15N3O4/c1-8(17)14-9-3-5-10(6-4-9)15-12(18)11-7-20-13(19)16(11)2/h3-6,11H,7H2,1-2H3,(H,14,17)(H,15,18)
InChIKeyJHSRRDTYTBFZNB-UHFFFAOYSA-N
MW277.28 g/mol
LogP1.03
Rot. Bonds3

About N-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide

N-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide (PubChem CID 110650578) has the molecular formula C13H15N3O4 and a molecular weight of 277.28 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide
PubChem CID110650578
Molecular FormulaC13H15N3O4
Molecular Weight277.28 g/mol
Exact Mass277.11
IUPAC NameN-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)C2COC(=O)N2C)cc1
InChIInChI=1S/C13H15N3O4/c1-8(17)14-9-3-5-10(6-4-9)15-12(18)11-7-20-13(19)16(11)2/h3-6,11H,7H2,1-2H3,(H,14,17)(H,15,18)
InChIKeyJHSRRDTYTBFZNB-UHFFFAOYSA-N
XLogP1.03
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.28
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chloro-4-methoxyphenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide
CID 110650141
N-(4-acetamidophenyl)-1-methyl-5-oxopyrrolidine-2-carboxamide
CID 110687377
N-cyclopropyl-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide
CID 75556376
(4S)-3-[(4-acetamidophenyl)methyl]-N-(2-amino-2-oxoethyl)-2-oxo-1,3-oxazolidine-4-carboxamide
CID 50851577
N-(4-acetylphenyl)-1-methyl-5-oxopyrrolidine-2-carboxamide
CID 110687375
N-(4-acetamidophenyl)-1-hydroxypiperidine-2-carboxamide
CID 110194301
N-(4-acetamidophenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 23916671
(1S)-N-(4-acetamidophenyl)-2,2-dimethylcyclopropane-1-carboxamide
CID 6932479
N-[4-(3,5-dimethylmorpholin-4-yl)phenyl]acetamide
CID 110637499
N-(4-acetamidophenyl)spiro[2.3]hexane-2-carboxamide
CID 56689692
N-(4-acetamidophenyl)-5-oxo-6,7-dihydro-4H-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
CID 3160703
1-N-(4-acetamidophenyl)-2-N-(4-acetylphenyl)cyclopropane-1,2-dicarboxamide
CID 109143793

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide (CID 110650578) is N-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide is CC(=O)Nc1ccc(NC(=O)C2COC(=O)N2C)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide?
The InChIKey is JHSRRDTYTBFZNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O4/c1-8(17)14-9-3-5-10(6-4-9)15-12(18)11-7-20-13(19)16(11)2/h3-6,11H,7H2,1-2H3,(H,14,17)(H,15,18).
What are the key properties of N-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide?
N-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide has a molecular weight of 277.28 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-3-methyl-2-oxo-1,3-oxazolidine-4-carboxamide is sourced from PubChem (CID 110650578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).