N-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide

C18H20N2O2 — CID 39975965

IUPACN-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide
SMILESCC(=O)Nc1cccc(NC(=O)c2cc(C)cc(C)c2)c1C
InChIInChI=1S/C18H20N2O2/c1-11-8-12(2)10-15(9-11)18(22)20-17-7-5-6-16(13(17)3)19-14(4)21/h5-10H,1-4H3,(H,19,21)(H,20,22)
InChIKeyZSAUMYQCJWDOTQ-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.82
Rot. Bonds3

About N-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide

N-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide (PubChem CID 39975965) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is N-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide.

Molecular Properties

Compound NameN-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide
PubChem CID39975965
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC NameN-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide
SMILESCC(=O)Nc1cccc(NC(=O)c2cc(C)cc(C)c2)c1C
InChIInChI=1S/C18H20N2O2/c1-11-8-12(2)10-15(9-11)18(22)20-17-7-5-6-16(13(17)3)19-14(4)21/h5-10H,1-4H3,(H,19,21)(H,20,22)
InChIKeyZSAUMYQCJWDOTQ-UHFFFAOYSA-N
XLogP3.82
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-acetamido-N-(3-acetamido-2-methylphenyl)benzamide
CID 134019280
N-(2-iodophenyl)-3,5-dimethylbenzamide
CID 2118558
3-bromo-N-(2,3-dimethylphenyl)-5-methylbenzamide
CID 104851827
2-[(3,5-dimethylbenzoyl)amino]benzoic acid
CID 16771715
N-(3-iodo-2-methylphenyl)-3-methylbenzamide
CID 113368760
N-(3-acetylphenyl)-3,5-dimethylbenzamide
CID 969392
N-[2-(chloromethyl)phenyl]-3,5-dimethylbenzamide
CID 114298542
N-[1-(3-acetamido-2-methylanilino)-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide
CID 134019283
N-[(3-chloro-2-methylphenyl)carbamothioyl]-3,5-dimethylbenzamide
CID 918712
N-[4-[4-[(3,5-dimethylbenzoyl)amino]-3-methylphenyl]-2-methylphenyl]-3,5-dimethylbenzamide
CID 3343453
3,5-dichloro-N-(3-hydroxy-2-methylphenyl)benzamide
CID 64793609
N-[2-(ethylaminomethyl)phenyl]-3,5-dimethylbenzamide
CID 43601336

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide?
The IUPAC name of N-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide (CID 39975965) is N-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide.
What is the SMILES notation for N-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide?
The canonical SMILES for N-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide is CC(=O)Nc1cccc(NC(=O)c2cc(C)cc(C)c2)c1C.
What is the InChIKey of N-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide?
The InChIKey is ZSAUMYQCJWDOTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-11-8-12(2)10-15(9-11)18(22)20-17-7-5-6-16(13(17)3)19-14(4)21/h5-10H,1-4H3,(H,19,21)(H,20,22).
What are the key properties of N-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide?
N-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide has a molecular weight of 296.37 g/mol, XLogP of 3.82, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide is sourced from PubChem (CID 39975965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).