N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide

C17H19NO — CID 925377

IUPACN-(3,5-dimethylphenyl)-2,4-dimethylbenzamide
SMILESCc1cc(C)cc(NC(=O)c2ccc(C)cc2C)c1
InChIInChI=1S/C17H19NO/c1-11-5-6-16(14(4)8-11)17(19)18-15-9-12(2)7-13(3)10-15/h5-10H,1-4H3,(H,18,19)
InChIKeyJWKBMIALMKPDOO-UHFFFAOYSA-N
MW253.34 g/mol
LogP4.17
Rot. Bonds2

About N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide

N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide (PubChem CID 925377) has the molecular formula C17H19NO and a molecular weight of 253.34 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-2,4-dimethylbenzamide
PubChem CID925377
Molecular FormulaC17H19NO
Molecular Weight253.34 g/mol
Exact Mass253.15
IUPAC NameN-(3,5-dimethylphenyl)-2,4-dimethylbenzamide
SMILESCc1cc(C)cc(NC(=O)c2ccc(C)cc2C)c1
InChIInChI=1S/C17H19NO/c1-11-5-6-16(14(4)8-11)17(19)18-15-9-12(2)7-13(3)10-15/h5-10H,1-4H3,(H,18,19)
InChIKeyJWKBMIALMKPDOO-UHFFFAOYSA-N
XLogP4.17
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3,5-dichloro-4-hydroxyphenyl)-2,4-dimethylbenzamide
CID 82884847
N-(4-tert-butylphenyl)-2,4-dimethylbenzamide
CID 953234
4-amino-N-(3-bromo-5-methylphenyl)-2-methylbenzamide
CID 107578505
N-(2-chloro-4-methylphenyl)-2,4-dimethylbenzamide
CID 2557643
N-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide
CID 64788271
2,4-dimethyl-N-(4-propylphenyl)benzamide
CID 42237293
N-(3-bromo-5-methylphenyl)-2-fluoro-4-methylbenzamide
CID 107582986
N-(4-bromo-2-methylphenyl)-2,4-dimethylbenzamide
CID 953255
N-[4-(2-aminoethyl)phenyl]-2,4-dimethylbenzamide
CID 62302184
N-(3-chloro-4-fluorophenyl)-2,4-dimethylbenzamide
CID 969420
N-(4-bromo-3,5-dimethylphenyl)-2,5-dimethylbenzamide
CID 107574857
N-(4-butan-2-ylphenyl)-2,4-dimethylbenzamide
CID 4028729

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide?
The IUPAC name of N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide (CID 925377) is N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide is Cc1cc(C)cc(NC(=O)c2ccc(C)cc2C)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide?
The InChIKey is JWKBMIALMKPDOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c1-11-5-6-16(14(4)8-11)17(19)18-15-9-12(2)7-13(3)10-15/h5-10H,1-4H3,(H,18,19).
What are the key properties of N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide?
N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide has a molecular weight of 253.34 g/mol, XLogP of 4.17, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide is sourced from PubChem (CID 925377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).