N,N'-bis(2,4-dimethylphenyl)oxamide

C18H20N2O2 — CID 3416969

IUPACN,N'-bis(2,4-dimethylphenyl)oxamide
SMILESCc1ccc(NC(=O)C(=O)Nc2ccc(C)cc2C)c(C)c1
InChIInChI=1S/C18H20N2O2/c1-11-5-7-15(13(3)9-11)19-17(21)18(22)20-16-8-6-12(2)10-14(16)4/h5-10H,1-4H3,(H,19,21)(H,20,22)
InChIKeyKEHXDUBSUOPNKO-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.50
Rot. Bonds2

About N,N'-bis(2,4-dimethylphenyl)oxamide

N,N'-bis(2,4-dimethylphenyl)oxamide (PubChem CID 3416969) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is N,N'-bis(2,4-dimethylphenyl)oxamide.

Molecular Properties

Compound NameN,N'-bis(2,4-dimethylphenyl)oxamide
PubChem CID3416969
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC NameN,N'-bis(2,4-dimethylphenyl)oxamide
SMILESCc1ccc(NC(=O)C(=O)Nc2ccc(C)cc2C)c(C)c1
InChIInChI=1S/C18H20N2O2/c1-11-5-7-15(13(3)9-11)19-17(21)18(22)20-16-8-6-12(2)10-14(16)4/h5-10H,1-4H3,(H,19,21)(H,20,22)
InChIKeyKEHXDUBSUOPNKO-UHFFFAOYSA-N
XLogP3.50
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-(2,4-difluorophenyl)-N-(2,4-dimethylphenyl)oxamide
CID 44998488
N'-(2,5-dichlorophenyl)-N-(2,4-dimethylphenyl)oxamide
CID 108500949
N-(2-chloroethyl)-N'-(2,4-dimethylphenyl)oxamide
CID 108513846
N-(2,4-dimethylphenyl)carbamoyl fluoride
CID 88833294
N-(3-bromo-4-methylphenyl)-N'-(2,4-dimethylphenyl)oxamide
CID 108986806
N'-(2,4-dimethylphenyl)-N-[(2S)-2-hydroxypropyl]oxamide
CID 7033220
N-(4-cyanophenyl)-N'-(2,4-dimethylphenyl)oxamide
CID 108515416
N-(3-bromophenyl)-N'-(2,4-dimethylphenyl)oxamide
CID 108515470
N-(2,4-dimethylphenyl)-4-methylbenzamide
CID 774370
N-(4-hydroxy-2-methylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108509461
N-(2,4-dimethylphenyl)-2-methylidenepentanamide
CID 141225698
N'-(cyclohexylideneamino)-N-(2,4-dimethylphenyl)oxamide
CID 4677008

Frequently Asked Questions

What is the IUPAC name of N,N'-bis(2,4-dimethylphenyl)oxamide?
The IUPAC name of N,N'-bis(2,4-dimethylphenyl)oxamide (CID 3416969) is N,N'-bis(2,4-dimethylphenyl)oxamide.
What is the SMILES notation for N,N'-bis(2,4-dimethylphenyl)oxamide?
The canonical SMILES for N,N'-bis(2,4-dimethylphenyl)oxamide is Cc1ccc(NC(=O)C(=O)Nc2ccc(C)cc2C)c(C)c1.
What is the InChIKey of N,N'-bis(2,4-dimethylphenyl)oxamide?
The InChIKey is KEHXDUBSUOPNKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-11-5-7-15(13(3)9-11)19-17(21)18(22)20-16-8-6-12(2)10-14(16)4/h5-10H,1-4H3,(H,19,21)(H,20,22).
What are the key properties of N,N'-bis(2,4-dimethylphenyl)oxamide?
N,N'-bis(2,4-dimethylphenyl)oxamide has a molecular weight of 296.37 g/mol, XLogP of 3.50, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(2,4-dimethylphenyl)oxamide is sourced from PubChem (CID 3416969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).