2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide

C20H15F3N2O — CID 2811757

IUPAC2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCc1nc(C(F)(F)F)ccc1C(=O)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C20H15F3N2O/c1-13-15(11-12-18(24-13)20(21,22)23)19(26)25-17-10-6-5-9-16(17)14-7-3-2-4-8-14/h2-12H,1H3,(H,25,26)
InChIKeyKYSLWIOMMOXRMQ-UHFFFAOYSA-N
MW356.35 g/mol
LogP5.33
Rot. Bonds3

About 2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide

2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 2811757) has the molecular formula C20H15F3N2O and a molecular weight of 356.35 g/mol. Its IUPAC name is 2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID2811757
Molecular FormulaC20H15F3N2O
Molecular Weight356.35 g/mol
Exact Mass356.11
IUPAC Name2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCc1nc(C(F)(F)F)ccc1C(=O)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C20H15F3N2O/c1-13-15(11-12-18(24-13)20(21,22)23)19(26)25-17-10-6-5-9-16(17)14-7-3-2-4-8-14/h2-12H,1H3,(H,25,26)
InChIKeyKYSLWIOMMOXRMQ-UHFFFAOYSA-N
XLogP5.33
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.35
LogP ≤ 55.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide (CID 2811757) is 2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide is Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccccc1-c1ccccc1.
What is the InChIKey of 2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is KYSLWIOMMOXRMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F3N2O/c1-13-15(11-12-18(24-13)20(21,22)23)19(26)25-17-10-6-5-9-16(17)14-7-3-2-4-8-14/h2-12H,1H3,(H,25,26).
What are the key properties of 2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 356.35 g/mol, XLogP of 5.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-phenylphenyl)-6-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 2811757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).