N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide

C13H12N4O4 — CID 48528626

IUPACN-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
SMILESCc1cc(NC(=O)C(=O)Nc2ccccc2C(N)=O)no1
InChIInChI=1S/C13H12N4O4/c1-7-6-10(17-21-7)16-13(20)12(19)15-9-5-3-2-4-8(9)11(14)18/h2-6H,1H3,(H2,14,18)(H,15,19)(H,16,17,20)
InChIKeySDAYFFVUOQOVKK-UHFFFAOYSA-N
MW288.26 g/mol
LogP0.66
Rot. Bonds3

About N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide

N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide (PubChem CID 48528626) has the molecular formula C13H12N4O4 and a molecular weight of 288.26 g/mol. Its IUPAC name is N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide.

Molecular Properties

Compound NameN-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
PubChem CID48528626
Molecular FormulaC13H12N4O4
Molecular Weight288.26 g/mol
Exact Mass288.09
IUPAC NameN-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
SMILESCc1cc(NC(=O)C(=O)Nc2ccccc2C(N)=O)no1
InChIInChI=1S/C13H12N4O4/c1-7-6-10(17-21-7)16-13(20)12(19)15-9-5-3-2-4-8(9)11(14)18/h2-6H,1H3,(H2,14,18)(H,15,19)(H,16,17,20)
InChIKeySDAYFFVUOQOVKK-UHFFFAOYSA-N
XLogP0.66
TPSA127.32 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.26
LogP ≤ 50.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-(2-hydroxyphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 108514273
butyl 2-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoacetyl]amino]benzoate
CID 108514593
N-(2-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide
CID 108529456
N'-(5-methyl-1,2-oxazol-3-yl)-N-(2-pyrrolidin-1-ylphenyl)oxamide
CID 51080556
N-methyl-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 44996069
ethyl 2-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]acetyl]amino]benzoate
CID 109011291
N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108512277
N-methyl-2-[[2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanylacetyl]amino]benzamide
CID 34753814
N-(2,5-difluorophenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 108524041
N'-(2-carbamoylphenyl)-N-(2-ethylphenyl)oxamide
CID 108529346
N-(2-carbamoylphenyl)-N'-propan-2-yloxamide
CID 108503318
N'-(5-methyl-1,2-oxazol-3-yl)-N-(3-methylphenyl)oxamide
CID 44996030

Frequently Asked Questions

What is the IUPAC name of N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide?
The IUPAC name of N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide (CID 48528626) is N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide.
What is the SMILES notation for N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide?
The canonical SMILES for N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide is Cc1cc(NC(=O)C(=O)Nc2ccccc2C(N)=O)no1.
What is the InChIKey of N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide?
The InChIKey is SDAYFFVUOQOVKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O4/c1-7-6-10(17-21-7)16-13(20)12(19)15-9-5-3-2-4-8(9)11(14)18/h2-6H,1H3,(H2,14,18)(H,15,19)(H,16,17,20).
What are the key properties of N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide?
N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide has a molecular weight of 288.26 g/mol, XLogP of 0.66, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-carbamoylphenyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide is sourced from PubChem (CID 48528626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).