3,4-dimethyl-N-(4-methylphenyl)benzamide

C16H17NO — CID 3950718

IUPAC3,4-dimethyl-N-(4-methylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2ccc(C)c(C)c2)cc1
InChIInChI=1S/C16H17NO/c1-11-4-8-15(9-5-11)17-16(18)14-7-6-12(2)13(3)10-14/h4-10H,1-3H3,(H,17,18)
InChIKeyUTMHMVRIQVFQML-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.86
Rot. Bonds2

About 3,4-dimethyl-N-(4-methylphenyl)benzamide

3,4-dimethyl-N-(4-methylphenyl)benzamide (PubChem CID 3950718) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is 3,4-dimethyl-N-(4-methylphenyl)benzamide.

Molecular Properties

Compound Name3,4-dimethyl-N-(4-methylphenyl)benzamide
PubChem CID3950718
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Name3,4-dimethyl-N-(4-methylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2ccc(C)c(C)c2)cc1
InChIInChI=1S/C16H17NO/c1-11-4-8-15(9-5-11)17-16(18)14-7-6-12(2)13(3)10-14/h4-10H,1-3H3,(H,17,18)
InChIKeyUTMHMVRIQVFQML-UHFFFAOYSA-N
XLogP3.86
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-methoxy-4-methyl-N-(4-methylphenyl)benzamide
CID 9071746
4-bromo-3-methyl-N-(4-methylphenyl)benzamide
CID 113396750
ethane;4-methoxy-3-methyl-N-(4-methylphenyl)benzamide
CID 54213440
1-[4-[(3,4-dimethylbenzoyl)amino]anilino]ethylidene-dimethylazanium
CID 21440580
N-[4-(hydroxymethyl)phenyl]-3,4-dimethylbenzamide
CID 64793175
3,4-dimethyl-N-[4-(2-methylpropanoylamino)phenyl]benzamide
CID 893199
N-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]-3,4-dimethylbenzamide
CID 43185491
propan-2-yl 4-[(3,4-dimethylbenzoyl)amino]benzoate
CID 708962
4-ethenyl-3-methyl-N-(4-methylphenyl)benzamide
CID 20735310
4-bromo-N-(3,4-dimethylphenyl)-3-methylbenzamide
CID 113396743
3,4-dimethyl-N-[4-(2-methylpropylamino)phenyl]benzamide
CID 112980349
3,4-dimethyl-N-(4-phenyldiazenylphenyl)benzamide
CID 3466026

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-N-(4-methylphenyl)benzamide?
The IUPAC name of 3,4-dimethyl-N-(4-methylphenyl)benzamide (CID 3950718) is 3,4-dimethyl-N-(4-methylphenyl)benzamide.
What is the SMILES notation for 3,4-dimethyl-N-(4-methylphenyl)benzamide?
The canonical SMILES for 3,4-dimethyl-N-(4-methylphenyl)benzamide is Cc1ccc(NC(=O)c2ccc(C)c(C)c2)cc1.
What is the InChIKey of 3,4-dimethyl-N-(4-methylphenyl)benzamide?
The InChIKey is UTMHMVRIQVFQML-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c1-11-4-8-15(9-5-11)17-16(18)14-7-6-12(2)13(3)10-14/h4-10H,1-3H3,(H,17,18).
What are the key properties of 3,4-dimethyl-N-(4-methylphenyl)benzamide?
3,4-dimethyl-N-(4-methylphenyl)benzamide has a molecular weight of 239.32 g/mol, XLogP of 3.86, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-N-(4-methylphenyl)benzamide is sourced from PubChem (CID 3950718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).