3-amino-N,N-dimethyl-5-phenylbenzamide

C15H16N2O — CID 138985388

IUPAC3-amino-N,N-dimethyl-5-phenylbenzamide
SMILESCN(C)C(=O)c1cc(N)cc(-c2ccccc2)c1
InChIInChI=1S/C15H16N2O/c1-17(2)15(18)13-8-12(9-14(16)10-13)11-6-4-3-5-7-11/h3-10H,16H2,1-2H3
InChIKeyJRCPJOXXFXXGKL-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.64
Rot. Bonds2

About 3-amino-N,N-dimethyl-5-phenylbenzamide

3-amino-N,N-dimethyl-5-phenylbenzamide (PubChem CID 138985388) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 3-amino-N,N-dimethyl-5-phenylbenzamide.

Molecular Properties

Compound Name3-amino-N,N-dimethyl-5-phenylbenzamide
PubChem CID138985388
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name3-amino-N,N-dimethyl-5-phenylbenzamide
SMILESCN(C)C(=O)c1cc(N)cc(-c2ccccc2)c1
InChIInChI=1S/C15H16N2O/c1-17(2)15(18)13-8-12(9-14(16)10-13)11-6-4-3-5-7-11/h3-10H,16H2,1-2H3
InChIKeyJRCPJOXXFXXGKL-UHFFFAOYSA-N
XLogP2.64
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 ≤ 52.64
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

3,5-diamino-N-benzyl-N-methylbenzamide
CID 61092300
[3-amino-5-(dimethylcarbamoyl)phenyl]boronic acid
CID 74890396
N,N-dimethyl-3-(4-methylphenyl)benzamide
CID 121373381
3-(5-amino-2-methylphenyl)-N,N-dimethylbenzamide
CID 146207479
3-amino-5-phenylphenol
CID 59648461
5-(dimethylcarbamoyl)benzene-1,3-dicarboxylic acid
CID 70359048
3-(3-acetamidophenyl)-5-aminobenzoic acid
CID 53227021
4-benzoyl-N,N-dimethylbenzamide
CID 12779824
N,N-dimethyl-4,5-diphenylthiophene-2-carboxamide
CID 20823378
3-(2-amino-4-phenylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide
CID 68913326
N,N-dimethyl-3-[(4-phenylbenzoyl)amino]benzamide
CID 17231735
3-[2-(2-aminopropan-2-yl)phenyl]-N,N-dimethylbenzamide
CID 21352681

Frequently Asked Questions

What is the IUPAC name of 3-amino-N,N-dimethyl-5-phenylbenzamide?
The IUPAC name of 3-amino-N,N-dimethyl-5-phenylbenzamide (CID 138985388) is 3-amino-N,N-dimethyl-5-phenylbenzamide.
What is the SMILES notation for 3-amino-N,N-dimethyl-5-phenylbenzamide?
The canonical SMILES for 3-amino-N,N-dimethyl-5-phenylbenzamide is CN(C)C(=O)c1cc(N)cc(-c2ccccc2)c1.
What is the InChIKey of 3-amino-N,N-dimethyl-5-phenylbenzamide?
The InChIKey is JRCPJOXXFXXGKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-17(2)15(18)13-8-12(9-14(16)10-13)11-6-4-3-5-7-11/h3-10H,16H2,1-2H3.
What are the key properties of 3-amino-N,N-dimethyl-5-phenylbenzamide?
3-amino-N,N-dimethyl-5-phenylbenzamide has a molecular weight of 240.31 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N,N-dimethyl-5-phenylbenzamide is sourced from PubChem (CID 138985388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).