4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide

C13H8F4N2O — CID 123325760

IUPAC4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
SMILESNC(=O)c1cc(-c2cc(F)ccc2C(F)(F)F)ccn1
InChIInChI=1S/C13H8F4N2O/c14-8-1-2-10(13(15,16)17)9(6-8)7-3-4-19-11(5-7)12(18)20/h1-6H,(H2,18,20)
InChIKeyMGWBPQOSLVCCOB-UHFFFAOYSA-N
MW284.21 g/mol
LogP3.01
Rot. Bonds2

About 4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide

4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide (PubChem CID 123325760) has the molecular formula C13H8F4N2O and a molecular weight of 284.21 g/mol. Its IUPAC name is 4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
PubChem CID123325760
Molecular FormulaC13H8F4N2O
Molecular Weight284.21 g/mol
Exact Mass284.06
IUPAC Name4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
SMILESNC(=O)c1cc(-c2cc(F)ccc2C(F)(F)F)ccn1
InChIInChI=1S/C13H8F4N2O/c14-8-1-2-10(13(15,16)17)9(6-8)7-3-4-19-11(5-7)12(18)20/h1-6H,(H2,18,20)
InChIKeyMGWBPQOSLVCCOB-UHFFFAOYSA-N
XLogP3.01
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.21
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide 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

4-[3-[2-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]pyridine-2-carboxamide
CID 166325517
4-[2-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid
CID 53223943
4-[2-(trifluoromethyl)phenoxy]pyridine-2-carboxamide
CID 123767237
4-[5-[2-(4-fluorophenyl)ethylcarbamoyl]thiophen-2-yl]pyridine-2-carboxamide
CID 59856937
4-[[2-fluoro-6-(4-fluorophenoxy)-3-(trifluoromethyl)benzoyl]amino]pyridine-2-carboxamide
CID 137410935
4-[5-fluoro-2-(trifluoromethyl)phenyl]benzaldehyde
CID 118874792
4-[N-methyl-2-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 123368878
4-[2-[[3-(trifluoromethyl)-2-pyridinyl]amino]ethylamino]pyridine-2-carboxamide
CID 133313933
2-[5-(2-carbamoyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetic acid;2,2,2-trifluoroacetic acid
CID 175839307
4-(2-carbamoyl-4-pyridinyl)benzenesulfinate
CID 167479075
3-(2-carboxy-5-fluorophenyl)-4-(trifluoromethyl)benzoic acid
CID 173322334
2-methyl-2-[[4-[2-(trifluoromethyl)phenyl]-2-pyridinyl]methylamino]propanamide;hydrochloride
CID 69235742

Frequently Asked Questions

What is the IUPAC name of 4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
The IUPAC name of 4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide (CID 123325760) is 4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for 4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide is NC(=O)c1cc(-c2cc(F)ccc2C(F)(F)F)ccn1.
What is the InChIKey of 4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
The InChIKey is MGWBPQOSLVCCOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8F4N2O/c14-8-1-2-10(13(15,16)17)9(6-8)7-3-4-19-11(5-7)12(18)20/h1-6H,(H2,18,20).
What are the key properties of 4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide?
4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide has a molecular weight of 284.21 g/mol, XLogP of 3.01, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-fluoro-2-(trifluoromethyl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 123325760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).