N-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide

C24H25N3O2 — CID 108511452

IUPACN-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide
SMILESCCc1cccc(CC)c1NC(=O)C(=O)Nc1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C24H25N3O2/c1-3-17-9-8-10-18(4-2)22(17)27-24(29)23(28)26-21-15-13-20(14-16-21)25-19-11-6-5-7-12-19/h5-16,25H,3-4H2,1-2H3,(H,26,28)(H,27,29)
InChIKeyQSNPQCWFNNWGOI-UHFFFAOYSA-N
MW387.48 g/mol
LogP5.13
Rot. Bonds6

About N-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide

N-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide (PubChem CID 108511452) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is N-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide.

Molecular Properties

Compound NameN-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide
PubChem CID108511452
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC NameN-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide
SMILESCCc1cccc(CC)c1NC(=O)C(=O)Nc1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C24H25N3O2/c1-3-17-9-8-10-18(4-2)22(17)27-24(29)23(28)26-21-15-13-20(14-16-21)25-19-11-6-5-7-12-19/h5-16,25H,3-4H2,1-2H3,(H,26,28)(H,27,29)
InChIKeyQSNPQCWFNNWGOI-UHFFFAOYSA-N
XLogP5.13
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.48
LogP ≤ 55.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-acetylphenyl)-N'-(2,6-diethylphenyl)oxamide
CID 108511377
N'-(2,6-diethylphenyl)-N-[4-(dimethylamino)phenyl]oxamide
CID 108511474
2,6-diethyl-N-phenylaniline
CID 45095580
N-(3-bromophenyl)-N'-(2,6-diethylphenyl)oxamide
CID 108511493
ethyl 4-[[2-(2,6-diethylanilino)-2-oxoacetyl]amino]benzoate
CID 108500021
N-(4-anilinophenyl)-N'-(4-ethoxyphenyl)oxamide
CID 108514453
N'-(2,6-diethylphenyl)-N-[3-(dimethylamino)phenyl]oxamide
CID 108511487
N,N'-bis(2-ethyl-6-methylphenyl)oxamide
CID 3725747
(Z)-N-(4-anilinophenyl)-2-methylpent-2-enamide
CID 60587211
N'-(4-anilinophenyl)-N-[(2-chlorophenyl)methyl]oxamide
CID 108506114
N-[4-[4-(4-anilinoanilino)anilino]phenyl]-2-methylprop-2-enamide
CID 102428329
N'-(4-anilinophenyl)-N-(2-hydroxypropyl)oxamide
CID 108521320

Frequently Asked Questions

What is the IUPAC name of N-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide?
The IUPAC name of N-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide (CID 108511452) is N-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide.
What is the SMILES notation for N-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide?
The canonical SMILES for N-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide is CCc1cccc(CC)c1NC(=O)C(=O)Nc1ccc(Nc2ccccc2)cc1.
What is the InChIKey of N-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide?
The InChIKey is QSNPQCWFNNWGOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c1-3-17-9-8-10-18(4-2)22(17)27-24(29)23(28)26-21-15-13-20(14-16-21)25-19-11-6-5-7-12-19/h5-16,25H,3-4H2,1-2H3,(H,26,28)(H,27,29).
What are the key properties of N-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide?
N-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide has a molecular weight of 387.48 g/mol, XLogP of 5.13, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-anilinophenyl)-N'-(2,6-diethylphenyl)oxamide is sourced from PubChem (CID 108511452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).