N,N'-bis(2,6-dimethylphenyl)oxamide

C18H20N2O2 — CID 3764178

IUPACN,N'-bis(2,6-dimethylphenyl)oxamide
SMILESCc1cccc(C)c1NC(=O)C(=O)Nc1c(C)cccc1C
InChIInChI=1S/C18H20N2O2/c1-11-7-5-8-12(2)15(11)19-17(21)18(22)20-16-13(3)9-6-10-14(16)4/h5-10H,1-4H3,(H,19,21)(H,20,22)
InChIKeyFFXRRIHTEGUDCH-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.50
Rot. Bonds2

About N,N'-bis(2,6-dimethylphenyl)oxamide

N,N'-bis(2,6-dimethylphenyl)oxamide (PubChem CID 3764178) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is N,N'-bis(2,6-dimethylphenyl)oxamide.

Molecular Properties

Compound NameN,N'-bis(2,6-dimethylphenyl)oxamide
PubChem CID3764178
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC NameN,N'-bis(2,6-dimethylphenyl)oxamide
SMILESCc1cccc(C)c1NC(=O)C(=O)Nc1c(C)cccc1C
InChIInChI=1S/C18H20N2O2/c1-11-7-5-8-12(2)15(11)19-17(21)18(22)20-16-13(3)9-6-10-14(16)4/h5-10H,1-4H3,(H,19,21)(H,20,22)
InChIKeyFFXRRIHTEGUDCH-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-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108512317
N,N'-bis(2-ethyl-6-methylphenyl)oxamide
CID 3725747
N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide
CID 108516687
N,3-bis(2,6-dimethylphenyl)-2-oxopropanamide
CID 158625322
(2E)-N-(2,6-dimethylphenyl)-2-hydroxyiminopropanamide
CID 176944148
N'-(2,6-dimethylphenyl)-N-(3-fluorophenyl)oxamide
CID 108531930
N-(4-bromo-3-methylphenyl)-N'-(2,6-dimethylphenyl)oxamide
CID 108532418
N-cycloheptyl-N'-(2,6-dimethylphenyl)oxamide
CID 7541637
2-amino-N-(2,6-dimethylphenyl)-2-iminoacetamide
CID 57023460
N-(2,5-difluorophenyl)-N'-(2,6-dimethylphenyl)oxamide
CID 108532429
N-(2-amino-5-methylphenyl)-N'-(2,6-dimethylphenyl)oxamide
CID 108532425
N'-(2,6-dimethylphenyl)-N-(4-sulfamoylphenyl)oxamide
CID 108508841

Frequently Asked Questions

What is the IUPAC name of N,N'-bis(2,6-dimethylphenyl)oxamide?
The IUPAC name of N,N'-bis(2,6-dimethylphenyl)oxamide (CID 3764178) is N,N'-bis(2,6-dimethylphenyl)oxamide.
What is the SMILES notation for N,N'-bis(2,6-dimethylphenyl)oxamide?
The canonical SMILES for N,N'-bis(2,6-dimethylphenyl)oxamide is Cc1cccc(C)c1NC(=O)C(=O)Nc1c(C)cccc1C.
What is the InChIKey of N,N'-bis(2,6-dimethylphenyl)oxamide?
The InChIKey is FFXRRIHTEGUDCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-11-7-5-8-12(2)15(11)19-17(21)18(22)20-16-13(3)9-6-10-14(16)4/h5-10H,1-4H3,(H,19,21)(H,20,22).
What are the key properties of N,N'-bis(2,6-dimethylphenyl)oxamide?
N,N'-bis(2,6-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(2,6-dimethylphenyl)oxamide is sourced from PubChem (CID 3764178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).