N-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide

C10H11F3N2O2 — CID 70972173

IUPACN-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
SMILESCCNC(=O)c1ccc(OCC(F)(F)F)nc1
InChIInChI=1S/C10H11F3N2O2/c1-2-14-9(16)7-3-4-8(15-5-7)17-6-10(11,12)13/h3-5H,2,6H2,1H3,(H,14,16)
InChIKeyBGRQFEPXNKNCTK-UHFFFAOYSA-N
MW248.20 g/mol
LogP1.77
Rot. Bonds4

About N-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide

N-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide (PubChem CID 70972173) has the molecular formula C10H11F3N2O2 and a molecular weight of 248.20 g/mol. Its IUPAC name is N-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
PubChem CID70972173
Molecular FormulaC10H11F3N2O2
Molecular Weight248.20 g/mol
Exact Mass248.08
IUPAC NameN-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
SMILESCCNC(=O)c1ccc(OCC(F)(F)F)nc1
InChIInChI=1S/C10H11F3N2O2/c1-2-14-9(16)7-3-4-8(15-5-7)17-6-10(11,12)13/h3-5H,2,6H2,1H3,(H,14,16)
InChIKeyBGRQFEPXNKNCTK-UHFFFAOYSA-N
XLogP1.77
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.20
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-oxo-1-(propylamino)propan-2-yl]-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 42933993
N-[(2R)-1-oxo-1-(propylamino)propan-2-yl]-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 26029790
N-(1-amino-2-methylpropan-2-yl)-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 119523407
N-[3-(propylcarbamoyl)phenyl]-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 55705978
6-(2,2,2-trifluoroethoxy)-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 55509070
N-pyridin-4-yl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 51323162
N-ethyl-4-iodo-3-(2,2,2-trifluoroethoxy)benzamide
CID 67216334
6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride
CID 165153609
N-pyridin-2-yl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 51322720
N-[(2R)-2-morpholin-4-ylpropyl]-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 94022187
N-(benzenecarboximidoyl)-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 146674404
6-(2,2,2-trifluoroethoxy)-N-[4-(trifluoromethyl)benzenecarboximidoyl]pyridine-3-carboxamide
CID 171130037

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide?
The IUPAC name of N-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide (CID 70972173) is N-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide?
The canonical SMILES for N-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide is CCNC(=O)c1ccc(OCC(F)(F)F)nc1.
What is the InChIKey of N-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide?
The InChIKey is BGRQFEPXNKNCTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O2/c1-2-14-9(16)7-3-4-8(15-5-7)17-6-10(11,12)13/h3-5H,2,6H2,1H3,(H,14,16).
What are the key properties of N-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide?
N-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide has a molecular weight of 248.20 g/mol, XLogP of 1.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide is sourced from PubChem (CID 70972173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).