N-(3-aminophenyl)-2,3-dimethylbenzamide

C15H16N2O — CID 16789314

IUPACN-(3-aminophenyl)-2,3-dimethylbenzamide
SMILESCc1cccc(C(=O)Nc2cccc(N)c2)c1C
InChIInChI=1S/C15H16N2O/c1-10-5-3-8-14(11(10)2)15(18)17-13-7-4-6-12(16)9-13/h3-9H,16H2,1-2H3,(H,17,18)
InChIKeyCBMMHQKVWZIJFC-UHFFFAOYSA-N
MW240.31 g/mol
LogP3.14
Rot. Bonds2

About N-(3-aminophenyl)-2,3-dimethylbenzamide

N-(3-aminophenyl)-2,3-dimethylbenzamide (PubChem CID 16789314) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is N-(3-aminophenyl)-2,3-dimethylbenzamide.

Molecular Properties

Compound NameN-(3-aminophenyl)-2,3-dimethylbenzamide
PubChem CID16789314
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC NameN-(3-aminophenyl)-2,3-dimethylbenzamide
SMILESCc1cccc(C(=O)Nc2cccc(N)c2)c1C
InChIInChI=1S/C15H16N2O/c1-10-5-3-8-14(11(10)2)15(18)17-13-7-4-6-12(16)9-13/h3-9H,16H2,1-2H3,(H,17,18)
InChIKeyCBMMHQKVWZIJFC-UHFFFAOYSA-N
XLogP3.14
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-aminophenyl)-3-chloro-2-methylbenzamide
CID 110484087
N-(3,4-dimethylphenyl)-2,3-dimethylbenzamide
CID 26593883
N-(4-amino-3-chlorophenyl)-2,3-dimethylbenzamide
CID 82861424
N-(4-amino-2-chlorophenyl)-2,3-dimethylbenzamide
CID 16788699
2,3-dimethyl-N-pyridin-4-ylbenzamide
CID 27700072
2,3-dimethyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide
CID 43507775
N-[3-(3-aminoprop-1-ynyl)phenyl]-2,3-dimethylbenzamide
CID 60803778
N-[3-(2,3-dimethylbenzoyl)phenyl]-2-methylbenzamide
CID 846043
N-(3-aminophenyl)-3-methyl-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
CID 84614417
N-[3-[4-(hydroxycarbamoyl)phenyl]phenyl]-2,3-dimethylbenzamide
CID 87916007
N-(3-aminophenyl)-2-(trifluoromethyl)benzamide
CID 16774950
N-(3-aminophenyl)-4,5-dimethylthiophene-2-carboxamide
CID 62057768

Frequently Asked Questions

What is the IUPAC name of N-(3-aminophenyl)-2,3-dimethylbenzamide?
The IUPAC name of N-(3-aminophenyl)-2,3-dimethylbenzamide (CID 16789314) is N-(3-aminophenyl)-2,3-dimethylbenzamide.
What is the SMILES notation for N-(3-aminophenyl)-2,3-dimethylbenzamide?
The canonical SMILES for N-(3-aminophenyl)-2,3-dimethylbenzamide is Cc1cccc(C(=O)Nc2cccc(N)c2)c1C.
What is the InChIKey of N-(3-aminophenyl)-2,3-dimethylbenzamide?
The InChIKey is CBMMHQKVWZIJFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-10-5-3-8-14(11(10)2)15(18)17-13-7-4-6-12(16)9-13/h3-9H,16H2,1-2H3,(H,17,18).
What are the key properties of N-(3-aminophenyl)-2,3-dimethylbenzamide?
N-(3-aminophenyl)-2,3-dimethylbenzamide has a molecular weight of 240.31 g/mol, XLogP of 3.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminophenyl)-2,3-dimethylbenzamide is sourced from PubChem (CID 16789314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).