2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide

C18H21NO — CID 8760033

IUPAC2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide
SMILESCc1cc(C)c(NC(=O)c2cccc(C)c2C)c(C)c1
InChIInChI=1S/C18H21NO/c1-11-9-13(3)17(14(4)10-11)19-18(20)16-8-6-7-12(2)15(16)5/h6-10H,1-5H3,(H,19,20)
InChIKeyWSBMCTOCIYSYEY-UHFFFAOYSA-N
MW267.37 g/mol
LogP4.48
Rot. Bonds2

About 2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide

2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide (PubChem CID 8760033) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide.

Molecular Properties

Compound Name2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide
PubChem CID8760033
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide
SMILESCc1cc(C)c(NC(=O)c2cccc(C)c2C)c(C)c1
InChIInChI=1S/C18H21NO/c1-11-9-13(3)17(14(4)10-11)19-18(20)16-8-6-7-12(2)15(16)5/h6-10H,1-5H3,(H,19,20)
InChIKeyWSBMCTOCIYSYEY-UHFFFAOYSA-N
XLogP4.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(2,4,6-trimethylphenyl)carbamoyl]benzoic acid
CID 2249172
3-methyl-2-nitro-N-(2,4,6-trimethylphenyl)benzamide
CID 4255599
methyl 2-[(2,4,6-trimethylphenyl)carbamoyl]benzoate
CID 108785438
2-hydrazinyl-N-(2,4,6-trimethylphenyl)benzamide
CID 62235197
N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108512317
N-(3,4-dimethylphenyl)-2,3-dimethylbenzamide
CID 26593883
2-(trifluoromethyl)-N-(2,4,6-trimethylphenyl)benzamide
CID 7899789
4-hydroxy-2-methyl-N-(2,4,6-trimethylphenyl)benzamide
CID 103863704
2-[(2,3-dimethylbenzoyl)amino]-5-hydroxybenzoic acid
CID 61405897
N-(3-aminophenyl)-2,3-dimethylbenzamide
CID 16789314
2,3-dimethylbenzohydrazide
CID 16790549
ethane;N,2,3-trimethylbenzamide
CID 178108869

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide?
The IUPAC name of 2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide (CID 8760033) is 2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide.
What is the SMILES notation for 2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide?
The canonical SMILES for 2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide is Cc1cc(C)c(NC(=O)c2cccc(C)c2C)c(C)c1.
What is the InChIKey of 2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide?
The InChIKey is WSBMCTOCIYSYEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-11-9-13(3)17(14(4)10-11)19-18(20)16-8-6-7-12(2)15(16)5/h6-10H,1-5H3,(H,19,20).
What are the key properties of 2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide?
2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide has a molecular weight of 267.37 g/mol, XLogP of 4.48, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzamide is sourced from PubChem (CID 8760033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).