N-(3-aminophenyl)-N,4-dimethylbenzamide

C15H16N2O — CID 61296197

IUPACN-(3-aminophenyl)-N,4-dimethylbenzamide
SMILESCc1ccc(C(=O)N(C)c2cccc(N)c2)cc1
InChIInChI=1S/C15H16N2O/c1-11-6-8-12(9-7-11)15(18)17(2)14-5-3-4-13(16)10-14/h3-10H,16H2,1-2H3
InChIKeyGTZYDUSGYHTMDS-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.85
Rot. Bonds2

About N-(3-aminophenyl)-N,4-dimethylbenzamide

N-(3-aminophenyl)-N,4-dimethylbenzamide (PubChem CID 61296197) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is N-(3-aminophenyl)-N,4-dimethylbenzamide.

Molecular Properties

Compound NameN-(3-aminophenyl)-N,4-dimethylbenzamide
PubChem CID61296197
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC NameN-(3-aminophenyl)-N,4-dimethylbenzamide
SMILESCc1ccc(C(=O)N(C)c2cccc(N)c2)cc1
InChIInChI=1S/C15H16N2O/c1-11-6-8-12(9-7-11)15(18)17(2)14-5-3-4-13(16)10-14/h3-10H,16H2,1-2H3
InChIKeyGTZYDUSGYHTMDS-UHFFFAOYSA-N
XLogP2.85
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(3-aminophenyl)-N-methylnaphthalene-2-carboxamide
CID 61296378
N-(3-aminophenyl)-3-bromo-N-methylbenzamide
CID 61296754
4-amino-N-(3-bromophenyl)-N-methylbenzamide
CID 82094901
N-(3-aminophenyl)-N,6-dimethylpyridine-2-carboxamide
CID 61297130
N-(3-aminophenyl)-N,2,3-trimethylbenzamide
CID 61296941
N-(3-aminophenyl)-N-methyl-3-methylsulfonylbenzamide
CID 61297490
N-methyl-4-(methylamino)-N-(3-methylphenyl)benzamide
CID 62175593
4-amino-N-methyl-N-phenylbenzamide
CID 4306081
N-[3-[benzoyl(methyl)amino]phenyl]-N-methylbenzamide
CID 59642334
N-(3-aminophenyl)-N-methyl-3-propoxybenzamide
CID 62918808
N-(3-aminophenyl)-N,2,4-trimethyl-1,3-thiazole-5-carboxamide
CID 114034032
N-(4-fluorophenyl)-N,4-dimethylbenzamide
CID 90825251

Frequently Asked Questions

What is the IUPAC name of N-(3-aminophenyl)-N,4-dimethylbenzamide?
The IUPAC name of N-(3-aminophenyl)-N,4-dimethylbenzamide (CID 61296197) is N-(3-aminophenyl)-N,4-dimethylbenzamide.
What is the SMILES notation for N-(3-aminophenyl)-N,4-dimethylbenzamide?
The canonical SMILES for N-(3-aminophenyl)-N,4-dimethylbenzamide is Cc1ccc(C(=O)N(C)c2cccc(N)c2)cc1.
What is the InChIKey of N-(3-aminophenyl)-N,4-dimethylbenzamide?
The InChIKey is GTZYDUSGYHTMDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-11-6-8-12(9-7-11)15(18)17(2)14-5-3-4-13(16)10-14/h3-10H,16H2,1-2H3.
What are the key properties of N-(3-aminophenyl)-N,4-dimethylbenzamide?
N-(3-aminophenyl)-N,4-dimethylbenzamide has a molecular weight of 240.31 g/mol, XLogP of 2.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminophenyl)-N,4-dimethylbenzamide is sourced from PubChem (CID 61296197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).