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

C14H11F3N2O — CID 11580007

IUPAC2-methyl-N-phenyl-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCc1nc(C(F)(F)F)ccc1C(=O)Nc1ccccc1
InChIInChI=1S/C14H11F3N2O/c1-9-11(7-8-12(18-9)14(15,16)17)13(20)19-10-5-3-2-4-6-10/h2-8H,1H3,(H,19,20)
InChIKeyMZWOSJFZHXSYBP-UHFFFAOYSA-N
MW280.25 g/mol
LogP3.66
Rot. Bonds2

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

2-methyl-N-phenyl-6-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 11580007) has the molecular formula C14H11F3N2O and a molecular weight of 280.25 g/mol. Its IUPAC name is 2-methyl-N-phenyl-6-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-phenyl-6-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID11580007
Molecular FormulaC14H11F3N2O
Molecular Weight280.25 g/mol
Exact Mass280.08
IUPAC Name2-methyl-N-phenyl-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCc1nc(C(F)(F)F)ccc1C(=O)Nc1ccccc1
InChIInChI=1S/C14H11F3N2O/c1-9-11(7-8-12(18-9)14(15,16)17)13(20)19-10-5-3-2-4-6-10/h2-8H,1H3,(H,19,20)
InChIKeyMZWOSJFZHXSYBP-UHFFFAOYSA-N
XLogP3.66
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.25
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-phenyl-6-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-phenyl-6-(trifluoromethyl)pyridine-3-carboxamide (CID 11580007) is 2-methyl-N-phenyl-6-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-phenyl-6-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-phenyl-6-(trifluoromethyl)pyridine-3-carboxamide is Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccccc1.
What is the InChIKey of 2-methyl-N-phenyl-6-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is MZWOSJFZHXSYBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F3N2O/c1-9-11(7-8-12(18-9)14(15,16)17)13(20)19-10-5-3-2-4-6-10/h2-8H,1H3,(H,19,20).
What are the key properties of 2-methyl-N-phenyl-6-(trifluoromethyl)pyridine-3-carboxamide?
2-methyl-N-phenyl-6-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 280.25 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-phenyl-6-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 11580007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).