N-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide

C10H11F3N2O — CID 166140733

IUPACN-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(C(F)(F)F)nc1C
InChIInChI=1S/C10H11F3N2O/c1-3-9(16)15-7-4-5-8(10(11,12)13)14-6(7)2/h4-5H,3H2,1-2H3,(H,15,16)
InChIKeyZAXKLUSJKMOURC-UHFFFAOYSA-N
MW232.20 g/mol
LogP2.76
Rot. Bonds2

About N-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide

N-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide (PubChem CID 166140733) has the molecular formula C10H11F3N2O and a molecular weight of 232.20 g/mol. Its IUPAC name is N-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide.

Molecular Properties

Compound NameN-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide
PubChem CID166140733
Molecular FormulaC10H11F3N2O
Molecular Weight232.20 g/mol
Exact Mass232.08
IUPAC NameN-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(C(F)(F)F)nc1C
InChIInChI=1S/C10H11F3N2O/c1-3-9(16)15-7-4-5-8(10(11,12)13)14-6(7)2/h4-5H,3H2,1-2H3,(H,15,16)
InChIKeyZAXKLUSJKMOURC-UHFFFAOYSA-N
XLogP2.76
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.20
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-Dimethyl-3-pyridylamine
CID 76964
US10800755, Example 31
CID 142429285
Acetamide, N,N'-((2,6-pyridylidene)dimethylene)di-
CID 49857
2-Methyl-6-(trifluoromethyl)pyridin-3-amine
CID 3521850
2-Fluoro-6-methylpyridin-3-amine
CID 17750148
6-Fluoro-2-methylpyridin-3-amine
CID 24729240
Methyl(((6-(trifluoromethyl)pyridin-2-yl)methyl))amine
CID 70700692
6-Ethenyl-2-methylpyridin-3-amine
CID 74889034
2-Ethynyl-6-(trifluoromethyl)pyridin-3-amine
CID 89387237
2-Ethyl-6-(trifluoromethyl)pyridin-3-amine
CID 90433896
6-Butyl-2-methylpyridin-3-amine
CID 108180773
2-Ethyl-6-methylpyridin-3-amine
CID 119084895

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide?
The IUPAC name of N-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide (CID 166140733) is N-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide.
What is the SMILES notation for N-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide?
The canonical SMILES for N-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide is CCC(=O)Nc1ccc(C(F)(F)F)nc1C.
What is the InChIKey of N-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide?
The InChIKey is ZAXKLUSJKMOURC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O/c1-3-9(16)15-7-4-5-8(10(11,12)13)14-6(7)2/h4-5H,3H2,1-2H3,(H,15,16).
What are the key properties of N-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide?
N-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide has a molecular weight of 232.20 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]propanamide is sourced from PubChem (CID 166140733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).