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

C15H19F3N2O — CID 134020401

IUPACN-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCC1CCCCC1N(C)C(=O)c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C15H19F3N2O/c1-10-5-3-4-6-12(10)20(2)14(21)11-7-8-13(19-9-11)15(16,17)18/h7-10,12H,3-6H2,1-2H3
InChIKeyBMAFDPWILMKJQH-UHFFFAOYSA-N
MW300.32 g/mol
LogP3.75
Rot. Bonds2

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

N-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 134020401) has the molecular formula C15H19F3N2O and a molecular weight of 300.32 g/mol. Its IUPAC name is N-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID134020401
Molecular FormulaC15H19F3N2O
Molecular Weight300.32 g/mol
Exact Mass300.14
IUPAC NameN-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCC1CCCCC1N(C)C(=O)c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C15H19F3N2O/c1-10-5-3-4-6-12(10)20(2)14(21)11-7-8-13(19-9-11)15(16,17)18/h7-10,12H,3-6H2,1-2H3
InChIKeyBMAFDPWILMKJQH-UHFFFAOYSA-N
XLogP3.75
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.32
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(4-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 134026117
6-bromo-N-methyl-N-(2-methylcyclohexyl)pyridine-3-carboxamide
CID 66463517
4-fluoro-N-methyl-N-(2-methylcyclohexyl)-3-sulfanylbenzamide
CID 107026520
N-methyl-N-[2-[methyl-[6-(trifluoromethyl)pyridine-3-carbonyl]amino]ethyl]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 112843302
4-[[(2-methylcyclohexyl)-[[6-(trifluoromethyl)-3-pyridinyl]sulfinyl]amino]methyl]benzamide
CID 89495599
4-(N'-hydroxycarbamimidoyl)-N-methyl-N-(2-methylcyclohexyl)benzamide
CID 76912108
3,5-dihydroxy-N-methyl-N-(2-methylcyclohexyl)benzamide
CID 103891881
N-(2-chlorocyclohexyl)-N,6-dimethylpyridine-3-carboxamide
CID 102638056
N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 78853634
N-cycloheptyl-N-methyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 134036717
N-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridazin-3-amine
CID 133433754
bis[6-(trifluoromethyl)-3-pyridinyl]methanone
CID 87948655

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of N-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide (CID 134020401) is N-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for N-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide is CC1CCCCC1N(C)C(=O)c1ccc(C(F)(F)F)nc1.
What is the InChIKey of N-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is BMAFDPWILMKJQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2O/c1-10-5-3-4-6-12(10)20(2)14(21)11-7-8-13(19-9-11)15(16,17)18/h7-10,12H,3-6H2,1-2H3.
What are the key properties of N-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
N-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 300.32 g/mol, XLogP of 3.75, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 134020401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).