N-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide

C15H8F5N3O — CID 154652690

IUPACN-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESO=C(Nc1c[nH]c2cc(F)c(F)cc12)c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C15H8F5N3O/c16-9-3-8-11(4-10(9)17)21-6-12(8)23-14(24)7-1-2-13(22-5-7)15(18,19)20/h1-6,21H,(H,23,24)
InChIKeyOCIJKNVNAJLDDF-UHFFFAOYSA-N
MW341.24 g/mol
LogP4.11
Rot. Bonds2

About N-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide

N-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 154652690) has the molecular formula C15H8F5N3O and a molecular weight of 341.24 g/mol. Its IUPAC name is N-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID154652690
Molecular FormulaC15H8F5N3O
Molecular Weight341.24 g/mol
Exact Mass341.06
IUPAC NameN-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESO=C(Nc1c[nH]c2cc(F)c(F)cc12)c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C15H8F5N3O/c16-9-3-8-11(4-10(9)17)21-6-12(8)23-14(24)7-1-2-13(22-5-7)15(18,19)20/h1-6,21H,(H,23,24)
InChIKeyOCIJKNVNAJLDDF-UHFFFAOYSA-N
XLogP4.11
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.24
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-butoxy-N-(5,6-difluoro-1H-indol-3-yl)pyridine-3-carboxamide
CID 170068393
N-(5,6-difluoro-1H-indol-3-yl)-4-(2-hydroxypropan-2-yl)benzamide
CID 154652693
N-(2,4-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 33164256
N-(5,6-difluoro-1H-indol-3-yl)-6-(4,4-difluoropiperidin-1-yl)pyridine-3-carboxamide
CID 162445062
[(5,6-difluoro-1H-indol-3-yl)amino]-[6-(trifluoromethyl)-3-pyridinyl]methanol
CID 155005390
N-(5,6-difluoro-1H-indol-3-yl)-2-(trifluoromethyl)benzamide
CID 154652721
N-(5,6-difluoro-1H-indol-3-yl)-1-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]pyrazole-4-carboxamide
CID 162444806
N-(5,6-difluoro-1H-indol-3-yl)-2-(1-hydroxypropyl)pyridine-4-carboxamide
CID 162445208
N-(4-fluoro-2-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 86926666
N-(5,6-difluoro-1H-indol-3-yl)-5-fluoro-6-[6-(2,2,2-trifluoroethoxy)-2-azaspiro[3.3]heptan-2-yl]pyridine-3-carboxamide
CID 162444921
4-cyclohexyloxy-N-(5,6-difluoro-1H-indol-3-yl)benzamide
CID 162444906
N-(3-fluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 24685793

Frequently Asked Questions

What is the IUPAC name of N-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of N-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide (CID 154652690) is N-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for N-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide is O=C(Nc1c[nH]c2cc(F)c(F)cc12)c1ccc(C(F)(F)F)nc1.
What is the InChIKey of N-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is OCIJKNVNAJLDDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8F5N3O/c16-9-3-8-11(4-10(9)17)21-6-12(8)23-14(24)7-1-2-13(22-5-7)15(18,19)20/h1-6,21H,(H,23,24).
What are the key properties of N-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide?
N-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 341.24 g/mol, XLogP of 4.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6-difluoro-1H-indol-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 154652690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).