N-quinolin-5-yl-2-(trifluoromethyl)benzamide

C17H11F3N2O — CID 26242319

IUPACN-quinolin-5-yl-2-(trifluoromethyl)benzamide
SMILESO=C(Nc1cccc2ncccc12)c1ccccc1C(F)(F)F
InChIInChI=1S/C17H11F3N2O/c18-17(19,20)13-7-2-1-5-11(13)16(23)22-15-9-3-8-14-12(15)6-4-10-21-14/h1-10H,(H,22,23)
InChIKeySPKQVDZGXPLFEO-UHFFFAOYSA-N
MW316.28 g/mol
LogP4.51
Rot. Bonds2

About N-quinolin-5-yl-2-(trifluoromethyl)benzamide

N-quinolin-5-yl-2-(trifluoromethyl)benzamide (PubChem CID 26242319) has the molecular formula C17H11F3N2O and a molecular weight of 316.28 g/mol. Its IUPAC name is N-quinolin-5-yl-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-quinolin-5-yl-2-(trifluoromethyl)benzamide
PubChem CID26242319
Molecular FormulaC17H11F3N2O
Molecular Weight316.28 g/mol
Exact Mass316.08
IUPAC NameN-quinolin-5-yl-2-(trifluoromethyl)benzamide
SMILESO=C(Nc1cccc2ncccc12)c1ccccc1C(F)(F)F
InChIInChI=1S/C17H11F3N2O/c18-17(19,20)13-7-2-1-5-11(13)16(23)22-15-9-3-8-14-12(15)6-4-10-21-14/h1-10H,(H,22,23)
InChIKeySPKQVDZGXPLFEO-UHFFFAOYSA-N
XLogP4.51
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.28
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-quinolin-5-yl-2-(trifluoromethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-oxo-N-quinolin-5-yl-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 24608497
N-quinolin-5-ylpyridine-2-carboxamide
CID 3985423
1-phenyl-N-quinolin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 24573002
2,3,4-trifluoro-N-quinolin-5-ylbenzamide
CID 110868233
2-phenylsulfanyl-N-quinolin-5-ylpyridine-3-carboxamide
CID 55342888
2-chloro-N-quinolin-5-ylfuran-3-carboxamide
CID 106685203
N-[2-(trifluoromethyl)phenyl]naphthalene-1-carboxamide
CID 1278699
CID 73213052
CID 73213052
4-fluoro-2-methyl-N-quinolin-5-ylbenzamide
CID 115745134
2,2,2-trifluoro-1-quinolin-5-ylethanone
CID 81220183
2-methyl-6-phenyl-N-quinolin-5-ylpyridine-3-carboxamide
CID 34130475
N-[2-(trifluoromethyl)-4-[2-(trifluoromethyl)phenyl]phenyl]quinoline-4-carboxamide
CID 91238971

Frequently Asked Questions

What is the IUPAC name of N-quinolin-5-yl-2-(trifluoromethyl)benzamide?
The IUPAC name of N-quinolin-5-yl-2-(trifluoromethyl)benzamide (CID 26242319) is N-quinolin-5-yl-2-(trifluoromethyl)benzamide.
What is the SMILES notation for N-quinolin-5-yl-2-(trifluoromethyl)benzamide?
The canonical SMILES for N-quinolin-5-yl-2-(trifluoromethyl)benzamide is O=C(Nc1cccc2ncccc12)c1ccccc1C(F)(F)F.
What is the InChIKey of N-quinolin-5-yl-2-(trifluoromethyl)benzamide?
The InChIKey is SPKQVDZGXPLFEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11F3N2O/c18-17(19,20)13-7-2-1-5-11(13)16(23)22-15-9-3-8-14-12(15)6-4-10-21-14/h1-10H,(H,22,23).
What are the key properties of N-quinolin-5-yl-2-(trifluoromethyl)benzamide?
N-quinolin-5-yl-2-(trifluoromethyl)benzamide has a molecular weight of 316.28 g/mol, XLogP of 4.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-quinolin-5-yl-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 26242319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).