N-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide

C15H19F3N2O2 — CID 32656416

IUPACN-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
SMILESCC1CCC(NC(=O)Cn2cccc(C(F)(F)F)c2=O)CC1
InChIInChI=1S/C15H19F3N2O2/c1-10-4-6-11(7-5-10)19-13(21)9-20-8-2-3-12(14(20)22)15(16,17)18/h2-3,8,10-11H,4-7,9H2,1H3,(H,19,21)
InChIKeyNZHSOAWWNJAFQA-UHFFFAOYSA-N
MW316.32 g/mol
LogP2.56
Rot. Bonds3

About N-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide

N-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide (PubChem CID 32656416) has the molecular formula C15H19F3N2O2 and a molecular weight of 316.32 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
PubChem CID32656416
Molecular FormulaC15H19F3N2O2
Molecular Weight316.32 g/mol
Exact Mass316.14
IUPAC NameN-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
SMILESCC1CCC(NC(=O)Cn2cccc(C(F)(F)F)c2=O)CC1
InChIInChI=1S/C15H19F3N2O2/c1-10-4-6-11(7-5-10)19-13(21)9-20-8-2-3-12(14(20)22)15(16,17)18/h2-3,8,10-11H,4-7,9H2,1H3,(H,19,21)
InChIKeyNZHSOAWWNJAFQA-UHFFFAOYSA-N
XLogP2.56
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.32
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide?
The IUPAC name of N-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide (CID 32656416) is N-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide.
What is the SMILES notation for N-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide?
The canonical SMILES for N-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide is CC1CCC(NC(=O)Cn2cccc(C(F)(F)F)c2=O)CC1.
What is the InChIKey of N-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide?
The InChIKey is NZHSOAWWNJAFQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2O2/c1-10-4-6-11(7-5-10)19-13(21)9-20-8-2-3-12(14(20)22)15(16,17)18/h2-3,8,10-11H,4-7,9H2,1H3,(H,19,21).
What are the key properties of N-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide?
N-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide has a molecular weight of 316.32 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide is sourced from PubChem (CID 32656416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).