N,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide

C13H17F3N2O2 — CID 125490215

IUPACN,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESCCc1cc(C(=O)N(CC)CC)c(=O)[nH]c1C(F)(F)F
InChIInChI=1S/C13H17F3N2O2/c1-4-8-7-9(12(20)18(5-2)6-3)11(19)17-10(8)13(14,15)16/h7H,4-6H2,1-3H3,(H,17,19)
InChIKeyDLLGSXDPDFXFTN-UHFFFAOYSA-N
MW290.29 g/mol
LogP2.44
Rot. Bonds4

About N,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide

N,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide (PubChem CID 125490215) has the molecular formula C13H17F3N2O2 and a molecular weight of 290.29 g/mol. Its IUPAC name is N,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
PubChem CID125490215
Molecular FormulaC13H17F3N2O2
Molecular Weight290.29 g/mol
Exact Mass290.12
IUPAC NameN,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESCCc1cc(C(=O)N(CC)CC)c(=O)[nH]c1C(F)(F)F
InChIInChI=1S/C13H17F3N2O2/c1-4-8-7-9(12(20)18(5-2)6-3)11(19)17-10(8)13(14,15)16/h7H,4-6H2,1-3H3,(H,17,19)
InChIKeyDLLGSXDPDFXFTN-UHFFFAOYSA-N
XLogP2.44
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.29
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of N,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide (CID 125490215) is N,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for N,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for N,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide is CCc1cc(C(=O)N(CC)CC)c(=O)[nH]c1C(F)(F)F.
What is the InChIKey of N,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The InChIKey is DLLGSXDPDFXFTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17F3N2O2/c1-4-8-7-9(12(20)18(5-2)6-3)11(19)17-10(8)13(14,15)16/h7H,4-6H2,1-3H3,(H,17,19).
What are the key properties of N,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
N,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide has a molecular weight of 290.29 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,5-triethyl-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 125490215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).