N,N'-bis(2,4,6-trimethylphenyl)oxamide

C20H24N2O2 — CID 13271247

IUPACN,N'-bis(2,4,6-trimethylphenyl)oxamide
SMILESCc1cc(C)c(NC(=O)C(=O)Nc2c(C)cc(C)cc2C)c(C)c1
InChIInChI=1S/C20H24N2O2/c1-11-7-13(3)17(14(4)8-11)21-19(23)20(24)22-18-15(5)9-12(2)10-16(18)6/h7-10H,1-6H3,(H,21,23)(H,22,24)
InChIKeyBYFNZGDOKWBBEN-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.11
Rot. Bonds2

About N,N'-bis(2,4,6-trimethylphenyl)oxamide

N,N'-bis(2,4,6-trimethylphenyl)oxamide (PubChem CID 13271247) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is N,N'-bis(2,4,6-trimethylphenyl)oxamide.

Molecular Properties

Compound NameN,N'-bis(2,4,6-trimethylphenyl)oxamide
PubChem CID13271247
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC NameN,N'-bis(2,4,6-trimethylphenyl)oxamide
SMILESCc1cc(C)c(NC(=O)C(=O)Nc2c(C)cc(C)cc2C)c(C)c1
InChIInChI=1S/C20H24N2O2/c1-11-7-13(3)17(14(4)8-11)21-19(23)20(24)22-18-15(5)9-12(2)10-16(18)6/h7-10H,1-6H3,(H,21,23)(H,22,24)
InChIKeyBYFNZGDOKWBBEN-UHFFFAOYSA-N
XLogP4.11
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.11
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'-pyrimidin-2-yl-N-(2,4,6-trimethylphenyl)oxamide
CID 108512217
N'-(2,6-difluorophenyl)-N-(2,4,6-trimethylphenyl)oxamide
CID 108512223
N-(4-hydroxy-2-methylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108509461
N-(4-chlorophenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108512199
N,N'-bis(2,4,6-trimethylphenyl)propanediamide
CID 746178
(E)-N,N'-bis(2,4,6-trimethylphenyl)but-2-enediamide
CID 1091194
N-(3-chloropropyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108512188
N-(2-bromophenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108512305
N-(2-amino-2-sulfanylideneethyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 43316123
N-(4-ethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 45000406
N-dodecyl-N'-(2,4,6-trimethylphenyl)oxamide
CID 3100446

Frequently Asked Questions

What is the IUPAC name of N,N'-bis(2,4,6-trimethylphenyl)oxamide?
The IUPAC name of N,N'-bis(2,4,6-trimethylphenyl)oxamide (CID 13271247) is N,N'-bis(2,4,6-trimethylphenyl)oxamide.
What is the SMILES notation for N,N'-bis(2,4,6-trimethylphenyl)oxamide?
The canonical SMILES for N,N'-bis(2,4,6-trimethylphenyl)oxamide is Cc1cc(C)c(NC(=O)C(=O)Nc2c(C)cc(C)cc2C)c(C)c1.
What is the InChIKey of N,N'-bis(2,4,6-trimethylphenyl)oxamide?
The InChIKey is BYFNZGDOKWBBEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-11-7-13(3)17(14(4)8-11)21-19(23)20(24)22-18-15(5)9-12(2)10-16(18)6/h7-10H,1-6H3,(H,21,23)(H,22,24).
What are the key properties of N,N'-bis(2,4,6-trimethylphenyl)oxamide?
N,N'-bis(2,4,6-trimethylphenyl)oxamide has a molecular weight of 324.42 g/mol, XLogP of 4.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(2,4,6-trimethylphenyl)oxamide is sourced from PubChem (CID 13271247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).