1-(trifluoromethyl)indole-2-carboxamide

C10H7F3N2O — CID 141282028

IUPAC1-(trifluoromethyl)indole-2-carboxamide
SMILESNC(=O)c1cc2ccccc2n1C(F)(F)F
InChIInChI=1S/C10H7F3N2O/c11-10(12,13)15-7-4-2-1-3-6(7)5-8(15)9(14)16/h1-5H,(H2,14,16)
InChIKeyAVTHSTQRNUNDDA-UHFFFAOYSA-N
MW228.17 g/mol
LogP2.22
Rot. Bonds1

About 1-(trifluoromethyl)indole-2-carboxamide

1-(trifluoromethyl)indole-2-carboxamide (PubChem CID 141282028) has the molecular formula C10H7F3N2O and a molecular weight of 228.17 g/mol. Its IUPAC name is 1-(trifluoromethyl)indole-2-carboxamide.

Molecular Properties

Compound Name1-(trifluoromethyl)indole-2-carboxamide
PubChem CID141282028
Molecular FormulaC10H7F3N2O
Molecular Weight228.17 g/mol
Exact Mass228.05
IUPAC Name1-(trifluoromethyl)indole-2-carboxamide
SMILESNC(=O)c1cc2ccccc2n1C(F)(F)F
InChIInChI=1S/C10H7F3N2O/c11-10(12,13)15-7-4-2-1-3-6(7)5-8(15)9(14)16/h1-5H,(H2,14,16)
InChIKeyAVTHSTQRNUNDDA-UHFFFAOYSA-N
XLogP2.22
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.17
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(trifluoromethyl)indole-2-carboxamide?
The IUPAC name of 1-(trifluoromethyl)indole-2-carboxamide (CID 141282028) is 1-(trifluoromethyl)indole-2-carboxamide.
What is the SMILES notation for 1-(trifluoromethyl)indole-2-carboxamide?
The canonical SMILES for 1-(trifluoromethyl)indole-2-carboxamide is NC(=O)c1cc2ccccc2n1C(F)(F)F.
What is the InChIKey of 1-(trifluoromethyl)indole-2-carboxamide?
The InChIKey is AVTHSTQRNUNDDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F3N2O/c11-10(12,13)15-7-4-2-1-3-6(7)5-8(15)9(14)16/h1-5H,(H2,14,16).
What are the key properties of 1-(trifluoromethyl)indole-2-carboxamide?
1-(trifluoromethyl)indole-2-carboxamide has a molecular weight of 228.17 g/mol, XLogP of 2.22, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(trifluoromethyl)indole-2-carboxamide is sourced from PubChem (CID 141282028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).