N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide

C9H9F3N2O — CID 176676959

IUPACN,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide
SMILESCNC(=O)c1cc(C)nc(C(F)(F)F)c1
InChIInChI=1S/C9H9F3N2O/c1-5-3-6(8(15)13-2)4-7(14-5)9(10,11)12/h3-4H,1-2H3,(H,13,15)
InChIKeyMEHFEASTJOSUAD-UHFFFAOYSA-N
MW218.18 g/mol
LogP1.77
Rot. Bonds1

About N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide

N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide (PubChem CID 176676959) has the molecular formula C9H9F3N2O and a molecular weight of 218.18 g/mol. Its IUPAC name is N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide
PubChem CID176676959
Molecular FormulaC9H9F3N2O
Molecular Weight218.18 g/mol
Exact Mass218.07
IUPAC NameN,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide
SMILESCNC(=O)c1cc(C)nc(C(F)(F)F)c1
InChIInChI=1S/C9H9F3N2O/c1-5-3-6(8(15)13-2)4-7(14-5)9(10,11)12/h3-4H,1-2H3,(H,13,15)
InChIKeyMEHFEASTJOSUAD-UHFFFAOYSA-N
XLogP1.77
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.18
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide?
The IUPAC name of N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide (CID 176676959) is N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide.
What is the SMILES notation for N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide?
The canonical SMILES for N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide is CNC(=O)c1cc(C)nc(C(F)(F)F)c1.
What is the InChIKey of N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide?
The InChIKey is MEHFEASTJOSUAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F3N2O/c1-5-3-6(8(15)13-2)4-7(14-5)9(10,11)12/h3-4H,1-2H3,(H,13,15).
What are the key properties of N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide?
N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide has a molecular weight of 218.18 g/mol, XLogP of 1.77, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide is sourced from PubChem (CID 176676959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).