N,N',N'-triphenyloxamide

C20H16N2O2 — CID 54357836

IUPACN,N',N'-triphenyloxamide
SMILESO=C(Nc1ccccc1)C(=O)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H16N2O2/c23-19(21-16-10-4-1-5-11-16)20(24)22(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H,(H,21,23)
InChIKeyUKJMIOPFHFPSTQ-UHFFFAOYSA-N
MW316.36 g/mol
LogP3.99
Rot. Bonds3

About N,N',N'-triphenyloxamide

N,N',N'-triphenyloxamide (PubChem CID 54357836) has the molecular formula C20H16N2O2 and a molecular weight of 316.36 g/mol. Its IUPAC name is N,N',N'-triphenyloxamide.

Molecular Properties

Compound NameN,N',N'-triphenyloxamide
PubChem CID54357836
Molecular FormulaC20H16N2O2
Molecular Weight316.36 g/mol
Exact Mass316.12
IUPAC NameN,N',N'-triphenyloxamide
SMILESO=C(Nc1ccccc1)C(=O)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H16N2O2/c23-19(21-16-10-4-1-5-11-16)20(24)22(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H,(H,21,23)
InChIKeyUKJMIOPFHFPSTQ-UHFFFAOYSA-N
XLogP3.99
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-(4-aminophenyl)-N-(4-fluorophenyl)-N'-phenyloxamide
CID 108512592
1,1-diphenyl-3-(phenylcarbamoyl)urea
CID 71359478
N'-tert-butyl-N,N'-diphenyloxamide
CID 141062085
N'-(4-aminophenyl)-N-(4-phenoxyphenyl)-N'-phenyloxamide
CID 108511634
N',N'-diethyl-N-phenyloxamide
CID 14925038
ethyl 4-[[2-(N-(4-aminophenyl)anilino)-2-oxoacetyl]amino]benzoate
CID 108500099
N-[4-[N-acetyl-4-(N-acetylanilino)anilino]phenyl]-2-methylprop-2-enamide
CID 101072014
potassium 2-anilino-2-oxoacetate
CID 23690423
N'-hydroxy-N-phenyloxamide
CID 5008441
2-anilino-N-phenylprop-2-enamide
CID 20522355
N'-(4-aminophenyl)-N'-phenyl-N-pyrimidin-2-yloxamide
CID 108520702
N'-ethyl-N'-(3-methylphenyl)-N-phenyloxamide
CID 108521844

Frequently Asked Questions

What is the IUPAC name of N,N',N'-triphenyloxamide?
The IUPAC name of N,N',N'-triphenyloxamide (CID 54357836) is N,N',N'-triphenyloxamide.
What is the SMILES notation for N,N',N'-triphenyloxamide?
The canonical SMILES for N,N',N'-triphenyloxamide is O=C(Nc1ccccc1)C(=O)N(c1ccccc1)c1ccccc1.
What is the InChIKey of N,N',N'-triphenyloxamide?
The InChIKey is UKJMIOPFHFPSTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O2/c23-19(21-16-10-4-1-5-11-16)20(24)22(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H,(H,21,23).
What are the key properties of N,N',N'-triphenyloxamide?
N,N',N'-triphenyloxamide has a molecular weight of 316.36 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N',N'-triphenyloxamide is sourced from PubChem (CID 54357836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).