N-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide

C13H7ClF4N2O — CID 103943594

IUPACN-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide
SMILESO=C(Nc1ncccc1Cl)c1cc(C(F)(F)F)ccc1F
InChIInChI=1S/C13H7ClF4N2O/c14-9-2-1-5-19-11(9)20-12(21)8-6-7(13(16,17)18)3-4-10(8)15/h1-6H,(H,19,20,21)
InChIKeyJLCWSJZTBIUTOX-UHFFFAOYSA-N
MW318.66 g/mol
LogP4.15
Rot. Bonds2

About N-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide

N-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide (PubChem CID 103943594) has the molecular formula C13H7ClF4N2O and a molecular weight of 318.66 g/mol. Its IUPAC name is N-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide
PubChem CID103943594
Molecular FormulaC13H7ClF4N2O
Molecular Weight318.66 g/mol
Exact Mass318.02
IUPAC NameN-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide
SMILESO=C(Nc1ncccc1Cl)c1cc(C(F)(F)F)ccc1F
InChIInChI=1S/C13H7ClF4N2O/c14-9-2-1-5-19-11(9)20-12(21)8-6-7(13(16,17)18)3-4-10(8)15/h1-6H,(H,19,20,21)
InChIKeyJLCWSJZTBIUTOX-UHFFFAOYSA-N
XLogP4.15
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.66
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3-chloro-2-pyridinyl)-2-fluoro-5-(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-bromo-N-(3-chloro-2-pyridinyl)-5-(trifluoromethyl)benzamide
CID 103943464
2-fluoro-N-(3-formyl-2-pyridinyl)-5-(trifluoromethyl)benzamide
CID 173323900
N-(3-chloro-2-pyridinyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 103892875
2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide
CID 103892911
2-bromo-N-(3-chloro-2-pyridinyl)-4-fluorobenzamide
CID 103893012
N-(3-chloro-2-pyridinyl)-4,5-difluoro-2-nitrobenzamide
CID 103943536
5-amino-2-bromo-N-(3-chloro-2-pyridinyl)-4-fluorobenzamide
CID 103093873
N-(3-chloro-2-pyridinyl)-2-fluoro-3-methylbenzamide
CID 103943460
N-(4-chlorophenyl)-2-[3-(trifluoromethyl)anilino]pyridine-3-carboxamide
CID 1263788
2,5-dichloro-N-(3-chloro-2-pyridinyl)pyridine-4-carboxamide
CID 102610397
3-bromo-N-(3-chloro-2-pyridinyl)-2-fluorobenzamide
CID 106547626
2-fluoro-N-(3-fluoro-4-pyridinyl)-5-(trifluoromethyl)benzamide
CID 103874425

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide?
The IUPAC name of N-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide (CID 103943594) is N-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide.
What is the SMILES notation for N-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide?
The canonical SMILES for N-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide is O=C(Nc1ncccc1Cl)c1cc(C(F)(F)F)ccc1F.
What is the InChIKey of N-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide?
The InChIKey is JLCWSJZTBIUTOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7ClF4N2O/c14-9-2-1-5-19-11(9)20-12(21)8-6-7(13(16,17)18)3-4-10(8)15/h1-6H,(H,19,20,21).
What are the key properties of N-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide?
N-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide has a molecular weight of 318.66 g/mol, XLogP of 4.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-pyridinyl)-2-fluoro-5-(trifluoromethyl)benzamide is sourced from PubChem (CID 103943594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).