2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide

C15H13F3N2O — CID 62511382

IUPAC2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide
SMILESCc1ccc(N)c(C(=O)Nc2ccccc2C(F)(F)F)c1
InChIInChI=1S/C15H13F3N2O/c1-9-6-7-12(19)10(8-9)14(21)20-13-5-3-2-4-11(13)15(16,17)18/h2-8H,19H2,1H3,(H,20,21)
InChIKeyOHCIHYLPWFRELI-UHFFFAOYSA-N
MW294.28 g/mol
LogP3.85
Rot. Bonds2

About 2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide

2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide (PubChem CID 62511382) has the molecular formula C15H13F3N2O and a molecular weight of 294.28 g/mol. Its IUPAC name is 2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide
PubChem CID62511382
Molecular FormulaC15H13F3N2O
Molecular Weight294.28 g/mol
Exact Mass294.10
IUPAC Name2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide
SMILESCc1ccc(N)c(C(=O)Nc2ccccc2C(F)(F)F)c1
InChIInChI=1S/C15H13F3N2O/c1-9-6-7-12(19)10(8-9)14(21)20-13-5-3-2-4-11(13)15(16,17)18/h2-8H,19H2,1H3,(H,20,21)
InChIKeyOHCIHYLPWFRELI-UHFFFAOYSA-N
XLogP3.85
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.28
LogP ≤ 53.85
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

2-[(3-methylbenzoyl)amino]-N-[2-(trifluoromethyl)phenyl]benzamide
CID 9172409
4-amino-3-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide
CID 62679068
2-bromo-3-methyl-N-[2-(trifluoromethyl)phenyl]benzamide
CID 103857081
2-amino-N-(2,3-dichlorophenyl)-5-methylbenzamide
CID 62509307
1-(2-fluoro-5-methylphenyl)-3-[2-(trifluoromethyl)phenyl]urea
CID 46859836
3,5-diamino-N-[2-(trifluoromethyl)phenyl]benzamide
CID 61091393
[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 2,5-dimethylbenzoate
CID 2520046
1-N-(4-methylphenyl)-3-N-[2-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide
CID 109056986
2-(2,5-dimethylphenyl)-N-[2-(trifluoromethyl)phenyl]quinoline-4-carboxamide
CID 2220779
methyl 2-[[2-(trifluoromethyl)phenyl]carbamoyl]benzoate
CID 108785392
N-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)benzamide
CID 7778212
2-amino-N-(2,6-dimethylphenyl)-5-methylbenzamide
CID 55083036

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide (CID 62511382) is 2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide is Cc1ccc(N)c(C(=O)Nc2ccccc2C(F)(F)F)c1.
What is the InChIKey of 2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide?
The InChIKey is OHCIHYLPWFRELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3N2O/c1-9-6-7-12(19)10(8-9)14(21)20-13-5-3-2-4-11(13)15(16,17)18/h2-8H,19H2,1H3,(H,20,21).
What are the key properties of 2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide?
2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide has a molecular weight of 294.28 g/mol, XLogP of 3.85, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 62511382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).