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

C19H22N2O2 — CID 108512317

IUPACN-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
SMILESCc1cc(C)c(NC(=O)C(=O)Nc2c(C)cccc2C)c(C)c1
InChIInChI=1S/C19H22N2O2/c1-11-9-14(4)17(15(5)10-11)21-19(23)18(22)20-16-12(2)7-6-8-13(16)3/h6-10H,1-5H3,(H,20,22)(H,21,23)
InChIKeyDZKSYVVUPVGPBF-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.81
Rot. Bonds2

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

N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide (PubChem CID 108512317) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
PubChem CID108512317
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
SMILESCc1cc(C)c(NC(=O)C(=O)Nc2c(C)cccc2C)c(C)c1
InChIInChI=1S/C19H22N2O2/c1-11-9-14(4)17(15(5)10-11)21-19(23)18(22)20-16-12(2)7-6-8-13(16)3/h6-10H,1-5H3,(H,20,22)(H,21,23)
InChIKeyDZKSYVVUPVGPBF-UHFFFAOYSA-N
XLogP3.81
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.81
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,N'-bis(2,6-dimethylphenyl)oxamide
CID 3764178
N,N'-bis(2,4,6-trimethylphenyl)oxamide
CID 13271247
N'-(2,6-difluorophenyl)-N-(2,4,6-trimethylphenyl)oxamide
CID 108512223
N'-pyrimidin-2-yl-N-(2,4,6-trimethylphenyl)oxamide
CID 108512217
N-(2-bromophenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108512305
N-[(3-methylphenyl)methyl]-N'-(2,4,6-trimethylphenyl)oxamide
CID 108984747
2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide
CID 8760033
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-(2-amino-5-methylphenyl)-N'-(2,6-dimethylphenyl)oxamide
CID 108532425
N-(2-carbamoylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108512277
N'-(2,6-dimethylphenyl)-N-(3-fluorophenyl)oxamide
CID 108531930

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide?
The IUPAC name of N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide (CID 108512317) is N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide is Cc1cc(C)c(NC(=O)C(=O)Nc2c(C)cccc2C)c(C)c1.
What is the InChIKey of N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide?
The InChIKey is DZKSYVVUPVGPBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-11-9-14(4)17(15(5)10-11)21-19(23)18(22)20-16-12(2)7-6-8-13(16)3/h6-10H,1-5H3,(H,20,22)(H,21,23).
What are the key properties of N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide?
N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide has a molecular weight of 310.40 g/mol, XLogP of 3.81, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide is sourced from PubChem (CID 108512317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).