N-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide

C23H15F3N2O — CID 69267048

IUPACN-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccc2ccccc2n1)c1ccccc1-c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C23H15F3N2O/c24-23(25,26)17-12-9-15(10-13-17)18-6-2-3-7-19(18)22(29)28-21-14-11-16-5-1-4-8-20(16)27-21/h1-14H,(H,27,28,29)
InChIKeyNEPPQEPZHZKWBE-UHFFFAOYSA-N
MW392.38 g/mol
LogP6.17
Rot. Bonds3

About N-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide

N-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide (PubChem CID 69267048) has the molecular formula C23H15F3N2O and a molecular weight of 392.38 g/mol. Its IUPAC name is N-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound NameN-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide
PubChem CID69267048
Molecular FormulaC23H15F3N2O
Molecular Weight392.38 g/mol
Exact Mass392.11
IUPAC NameN-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccc2ccccc2n1)c1ccccc1-c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C23H15F3N2O/c24-23(25,26)17-12-9-15(10-13-17)18-6-2-3-7-19(18)22(29)28-21-14-11-16-5-1-4-8-20(16)27-21/h1-14H,(H,27,28,29)
InChIKeyNEPPQEPZHZKWBE-UHFFFAOYSA-N
XLogP6.17
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.38
LogP ≤ 56.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(6-formylquinolin-2-yl)-2-[4-(trifluoromethyl)phenyl]benzamide
CID 59710980
methyl 2-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]quinoline-6-carboxylate
CID 59711001
N-[(1R)-1-(4-methylphenyl)ethyl]-2-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]quinoline-6-carboxamide
CID 59711004
methyl (2S)-2-phenyl-2-[[2-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]quinoline-6-carbonyl]amino]acetate
CID 59710991
N-[(1S)-2-methoxy-1-phenylethyl]-2-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]quinoline-6-carboxamide
CID 160909901
N-(2-methylphenyl)-2-[4-(trifluoromethyl)phenyl]benzamide
CID 2121231
N-[(1S)-2-(dibutylamino)-1-phenylethyl]-2-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]quinoline-6-carboxamide
CID 157208298
2,2-dimethyl-1-[2-[4-(trifluoromethyl)phenyl]phenyl]propan-1-one
CID 16680132
N-[2-[butyl(ethyl)amino]-2-oxo-1-phenylethyl]-2-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]quinoline-6-carboxamide
CID 154281432
N-[6-[[[(1S)-2-(diethylamino)-2-oxo-1-pyridin-2-ylethyl]-methylamino]methyl]quinolin-2-yl]-2-[4-(trifluoromethyl)phenyl]benzamide
CID 91510238
[6-[2-oxo-2-[4-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]anilino]ethyl]-2-pyridinyl]carbamic acid
CID 70001635
1-methyl-4-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]imidazole-2-carboxamide
CID 12051311

Frequently Asked Questions

What is the IUPAC name of N-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of N-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide (CID 69267048) is N-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for N-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for N-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide is O=C(Nc1ccc2ccccc2n1)c1ccccc1-c1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide?
The InChIKey is NEPPQEPZHZKWBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15F3N2O/c24-23(25,26)17-12-9-15(10-13-17)18-6-2-3-7-19(18)22(29)28-21-14-11-16-5-1-4-8-20(16)27-21/h1-14H,(H,27,28,29).
What are the key properties of N-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide?
N-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide has a molecular weight of 392.38 g/mol, XLogP of 6.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-quinolin-2-yl-2-[4-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 69267048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).