N-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide

C21H14F3N3O — CID 58279245

IUPACN-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide
SMILESO=C(Nc1ccccn1)c1cccc2c1N=C(c1ccccc1C(F)(F)F)C2
InChIInChI=1S/C21H14F3N3O/c22-21(23,24)16-9-2-1-7-14(16)17-12-13-6-5-8-15(19(13)26-17)20(28)27-18-10-3-4-11-25-18/h1-11H,12H2,(H,25,27,28)
InChIKeyYATCKVSPFOLNOS-UHFFFAOYSA-N
MW381.36 g/mol
LogP5.03
Rot. Bonds3

About N-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide

N-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide (PubChem CID 58279245) has the molecular formula C21H14F3N3O and a molecular weight of 381.36 g/mol. Its IUPAC name is N-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide.

Molecular Properties

Compound NameN-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide
PubChem CID58279245
Molecular FormulaC21H14F3N3O
Molecular Weight381.36 g/mol
Exact Mass381.11
IUPAC NameN-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide
SMILESO=C(Nc1ccccn1)c1cccc2c1N=C(c1ccccc1C(F)(F)F)C2
InChIInChI=1S/C21H14F3N3O/c22-21(23,24)16-9-2-1-7-14(16)17-12-13-6-5-8-15(19(13)26-17)20(28)27-18-10-3-4-11-25-18/h1-11H,12H2,(H,25,27,28)
InChIKeyYATCKVSPFOLNOS-UHFFFAOYSA-N
XLogP5.03
TPSA54.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.36
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide
CID 58279170
2-[5-fluoro-2-(trifluoromethyl)phenyl]-N-(1,3-thiazol-2-yl)-3H-indole-7-carboxamide
CID 58279339
N-(6-chloropyridazin-3-yl)-2-[3-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide
CID 58278684
2-chloro-N-pyridin-2-yl-3-(trifluoromethyl)quinoline-8-carboxamide
CID 87189922
2-phenyl-N-pyridin-2-yl-3-(trifluoromethyl)quinoline-8-carboxamide
CID 58154708
N'-pyridin-2-yl-2-(trifluoromethyl)benzohydrazide
CID 175943084
N-(5-methyl-1,3-thiazol-2-yl)-2-[3-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide
CID 58278852
2-[5-chloro-1-methyl-3-(trifluoromethyl)pyrazol-4-yl]-N-(1,3-thiazol-2-yl)-3H-indole-7-carboxamide
CID 58278966
N-(4-chloro-2-pyridinyl)-2-fluoro-3-(trifluoromethyl)benzamide
CID 115681910
N-pyridin-2-yl-2-[5-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]-1H-benzimidazole-4-carboxamide
CID 58279014
2-[2-(difluoromethyl)-4-fluorophenyl]-N-(1,3-thiazol-2-yl)-3H-indole-7-carboxamide
CID 58278747
7-methyl-N-pyridin-2-yl-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide
CID 71525492

Frequently Asked Questions

What is the IUPAC name of N-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide?
The IUPAC name of N-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide (CID 58279245) is N-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide.
What is the SMILES notation for N-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide?
The canonical SMILES for N-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide is O=C(Nc1ccccn1)c1cccc2c1N=C(c1ccccc1C(F)(F)F)C2.
What is the InChIKey of N-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide?
The InChIKey is YATCKVSPFOLNOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14F3N3O/c22-21(23,24)16-9-2-1-7-14(16)17-12-13-6-5-8-15(19(13)26-17)20(28)27-18-10-3-4-11-25-18/h1-11H,12H2,(H,25,27,28).
What are the key properties of N-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide?
N-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide has a molecular weight of 381.36 g/mol, XLogP of 5.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-2-yl-2-[2-(trifluoromethyl)phenyl]-3H-indole-7-carboxamide is sourced from PubChem (CID 58279245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).