N-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide

C11H14F3N3O — CID 105068933

IUPACN-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
SMILESCCN(CC(F)(F)F)C(=O)c1ccncc1NC
InChIInChI=1S/C11H14F3N3O/c1-3-17(7-11(12,13)14)10(18)8-4-5-16-6-9(8)15-2/h4-6,15H,3,7H2,1-2H3
InChIKeyDAEZOBJWTHKGER-UHFFFAOYSA-N
MW261.25 g/mol
LogP2.15
Rot. Bonds4

About N-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide

N-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide (PubChem CID 105068933) has the molecular formula C11H14F3N3O and a molecular weight of 261.25 g/mol. Its IUPAC name is N-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
PubChem CID105068933
Molecular FormulaC11H14F3N3O
Molecular Weight261.25 g/mol
Exact Mass261.11
IUPAC NameN-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
SMILESCCN(CC(F)(F)F)C(=O)c1ccncc1NC
InChIInChI=1S/C11H14F3N3O/c1-3-17(7-11(12,13)14)10(18)8-4-5-16-6-9(8)15-2/h4-6,15H,3,7H2,1-2H3
InChIKeyDAEZOBJWTHKGER-UHFFFAOYSA-N
XLogP2.15
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.25
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
CID 105071681
N-(cyclopropylmethyl)-N-ethyl-3-(methylamino)pyridine-4-carboxamide
CID 105070225
N-(2-hydroxyethyl)-3-(propylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
CID 107486117
N-ethyl-6-methyl-4-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 81243054
N-(cyclopropylmethyl)-3-ethyl-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
CID 86789424
N-[2-(dimethylamino)ethyl]-3-(methylamino)-N-(2-methylpropyl)pyridine-4-carboxamide
CID 105068956
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-3-(methylamino)pyridine-4-carboxamide
CID 107486032
N-ethyl-3-(methylamino)pyridine-4-carboxamide
CID 105068179
N-ethyl-3-hydrazinyl-N-propylpyridine-4-carboxamide
CID 105072006
N-butyl-3-fluoro-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
CID 113240838
N-benzyl-N-(2-hydroxyethyl)-3-(methylamino)pyridine-4-carboxamide
CID 105068839
N-cyclopropyl-3-(methylamino)-N-propylpyridine-4-carboxamide
CID 105068558

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide?
The IUPAC name of N-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide (CID 105068933) is N-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide.
What is the SMILES notation for N-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide?
The canonical SMILES for N-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide is CCN(CC(F)(F)F)C(=O)c1ccncc1NC.
What is the InChIKey of N-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide?
The InChIKey is DAEZOBJWTHKGER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3O/c1-3-17(7-11(12,13)14)10(18)8-4-5-16-6-9(8)15-2/h4-6,15H,3,7H2,1-2H3.
What are the key properties of N-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide?
N-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide has a molecular weight of 261.25 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide is sourced from PubChem (CID 105068933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).