N-methyl-3-(trifluoromethyl)pyridine-4-carboxamide

C8H7F3N2O — CID 58243648

IUPACN-methyl-3-(trifluoromethyl)pyridine-4-carboxamide
SMILESCNC(=O)c1ccncc1C(F)(F)F
InChIInChI=1S/C8H7F3N2O/c1-12-7(14)5-2-3-13-4-6(5)8(9,10)11/h2-4H,1H3,(H,12,14)
InChIKeyQKPANKOCBUSAAE-UHFFFAOYSA-N
MW204.15 g/mol
LogP1.46
Rot. Bonds1

About N-methyl-3-(trifluoromethyl)pyridine-4-carboxamide

N-methyl-3-(trifluoromethyl)pyridine-4-carboxamide (PubChem CID 58243648) has the molecular formula C8H7F3N2O and a molecular weight of 204.15 g/mol. Its IUPAC name is N-methyl-3-(trifluoromethyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-3-(trifluoromethyl)pyridine-4-carboxamide
PubChem CID58243648
Molecular FormulaC8H7F3N2O
Molecular Weight204.15 g/mol
Exact Mass204.05
IUPAC NameN-methyl-3-(trifluoromethyl)pyridine-4-carboxamide
SMILESCNC(=O)c1ccncc1C(F)(F)F
InChIInChI=1S/C8H7F3N2O/c1-12-7(14)5-2-3-13-4-6(5)8(9,10)11/h2-4H,1H3,(H,12,14)
InChIKeyQKPANKOCBUSAAE-UHFFFAOYSA-N
XLogP1.46
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.15
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-3-(trifluoromethyl)pyridine-4-carboxamide
CID 142421392
3-(trifluoromethyl)pyridine-4-carboxylate
CID 26986367
tert-butyl N-[[3-(trifluoromethyl)pyridine-4-carbonyl]amino]carbamate
CID 175174344
N-[(2R)-2-hydroxy-3-methylbutyl]-3-(trifluoromethyl)pyridine-4-carboxamide
CID 99779539
N-methyl-2-(trifluoromethyl)benzamide
CID 4216112
3-[[2-chloro-5-(trifluoromethyl)-4-pyridinyl]amino]-N-methylpyridine-4-carboxamide
CID 58155043
N-(3,5-difluoro-4-methylsulfanylphenyl)-3-(trifluoromethyl)pyridine-4-carboxamide
CID 122158437
4-(methylcarbamoyl)pyridine-3-carboxylic acid
CID 130493888
tris(3-hydroxy-N-methylpyridine-4-carboxamide);iron
CID 163419095
N-methyl-4-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 148743590
methanol;methyl 3-(trifluoromethyl)pyridine-4-carboxylate;3-(trifluoromethyl)pyridine-4-carbonyl chloride
CID 158055243
3-ethyl-N-methylpyridine-4-carboxamide
CID 130718112

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(trifluoromethyl)pyridine-4-carboxamide?
The IUPAC name of N-methyl-3-(trifluoromethyl)pyridine-4-carboxamide (CID 58243648) is N-methyl-3-(trifluoromethyl)pyridine-4-carboxamide.
What is the SMILES notation for N-methyl-3-(trifluoromethyl)pyridine-4-carboxamide?
The canonical SMILES for N-methyl-3-(trifluoromethyl)pyridine-4-carboxamide is CNC(=O)c1ccncc1C(F)(F)F.
What is the InChIKey of N-methyl-3-(trifluoromethyl)pyridine-4-carboxamide?
The InChIKey is QKPANKOCBUSAAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3N2O/c1-12-7(14)5-2-3-13-4-6(5)8(9,10)11/h2-4H,1H3,(H,12,14).
What are the key properties of N-methyl-3-(trifluoromethyl)pyridine-4-carboxamide?
N-methyl-3-(trifluoromethyl)pyridine-4-carboxamide has a molecular weight of 204.15 g/mol, XLogP of 1.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(trifluoromethyl)pyridine-4-carboxamide is sourced from PubChem (CID 58243648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).