3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide

C15H14F2N2O — CID 63187190

IUPAC3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide
SMILESCNc1c(F)cc(C(=O)Nc2ccc(C)cc2)cc1F
InChIInChI=1S/C15H14F2N2O/c1-9-3-5-11(6-4-9)19-15(20)10-7-12(16)14(18-2)13(17)8-10/h3-8,18H,1-2H3,(H,19,20)
InChIKeyRJSVDHQHNPXKHS-UHFFFAOYSA-N
MW276.29 g/mol
LogP3.57
Rot. Bonds3

About 3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide

3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide (PubChem CID 63187190) has the molecular formula C15H14F2N2O and a molecular weight of 276.29 g/mol. Its IUPAC name is 3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide.

Molecular Properties

Compound Name3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide
PubChem CID63187190
Molecular FormulaC15H14F2N2O
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC Name3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide
SMILESCNc1c(F)cc(C(=O)Nc2ccc(C)cc2)cc1F
InChIInChI=1S/C15H14F2N2O/c1-9-3-5-11(6-4-9)19-15(20)10-7-12(16)14(18-2)13(17)8-10/h3-8,18H,1-2H3,(H,19,20)
InChIKeyRJSVDHQHNPXKHS-UHFFFAOYSA-N
XLogP3.57
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-difluoro-N-(4-methylphenyl)benzamide
CID 2111363
4-amino-3-fluoro-N-(4-methylphenyl)benzamide
CID 55103260
3,4,5-trifluoro-N-(4-methylsulfanylphenyl)benzamide
CID 63188297
3-fluoro-N-(4-hydroxyphenyl)-5-methylbenzamide
CID 113246156
N-(3-bromo-2-methylphenyl)-3,5-difluoro-4-(methylamino)benzamide
CID 107631048
3-hydroxy-N-(4-methylphenyl)benzamide
CID 10900357
4-N-(3-fluorophenyl)-1-N-(4-methylphenyl)benzene-1,4-dicarboxamide
CID 109049444
2-fluoro-N-[4-[(4-methylbenzoyl)amino]phenyl]benzamide
CID 577368
N-(4-amino-3-methylphenyl)-3,4,5-trifluorobenzamide
CID 63183667
N-(4-methylphenyl)-4-[2-[4-[(4-methylphenyl)carbamoyl]phenyl]hydrazinyl]benzamide
CID 139337158
N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide
CID 2223178
4-methyl-N-[4-[[4-[(4-methylbenzoyl)amino]phenyl]methyl]phenyl]benzamide
CID 2330632

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide?
The IUPAC name of 3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide (CID 63187190) is 3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide.
What is the SMILES notation for 3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide?
The canonical SMILES for 3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide is CNc1c(F)cc(C(=O)Nc2ccc(C)cc2)cc1F.
What is the InChIKey of 3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide?
The InChIKey is RJSVDHQHNPXKHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O/c1-9-3-5-11(6-4-9)19-15(20)10-7-12(16)14(18-2)13(17)8-10/h3-8,18H,1-2H3,(H,19,20).
What are the key properties of 3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide?
3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide has a molecular weight of 276.29 g/mol, XLogP of 3.57, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-4-(methylamino)-N-(4-methylphenyl)benzamide is sourced from PubChem (CID 63187190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).