5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide

C11H14F3N3O — CID 55006975

IUPAC5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
SMILESCCN(CC(F)(F)F)C(=O)c1cc(N)cnc1C
InChIInChI=1S/C11H14F3N3O/c1-3-17(6-11(12,13)14)10(18)9-4-8(15)5-16-7(9)2/h4-5H,3,6,15H2,1-2H3
InChIKeyCKAKYMUBKKAYDU-UHFFFAOYSA-N
MW261.25 g/mol
LogP2.00
Rot. Bonds3

About 5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide

5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide (PubChem CID 55006975) has the molecular formula C11H14F3N3O and a molecular weight of 261.25 g/mol. Its IUPAC name is 5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
PubChem CID55006975
Molecular FormulaC11H14F3N3O
Molecular Weight261.25 g/mol
Exact Mass261.11
IUPAC Name5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
SMILESCCN(CC(F)(F)F)C(=O)c1cc(N)cnc1C
InChIInChI=1S/C11H14F3N3O/c1-3-17(6-11(12,13)14)10(18)9-4-8(15)5-16-7(9)2/h4-5H,3,6,15H2,1-2H3
InChIKeyCKAKYMUBKKAYDU-UHFFFAOYSA-N
XLogP2.00
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.25
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-N-ethyl-2-methyl-N-(2-methylpropyl)pyridine-3-carboxamide
CID 61040071
5-amino-N-ethyl-2-methyl-N-(2-methylbutyl)pyridine-3-carboxamide
CID 79477889
5-amino-2-[ethyl(2,2,2-trifluoroethyl)amino]pyridine-3-carboxamide
CID 55011243
5-amino-N-(2-amino-2-oxoethyl)-2-methyl-N-(2-methylpropyl)pyridine-3-carboxamide
CID 61108035
N-ethyl-6-methyl-4-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 81243054
5-amino-N-benzyl-2-methyl-N-propylpyridine-3-carboxamide
CID 61040072
5-amino-N-(3,3-dimethylbutan-2-yl)-N,2-dimethylpyridine-3-carboxamide
CID 61105565
5-amino-N-(2-methoxyethyl)-2-methyl-N-(2-methylpropyl)pyridine-3-carboxamide
CID 61107661
N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 78865711
5-amino-N-(2-cyanoethyl)-2-methyl-N-(2-methylpropyl)pyridine-3-carboxamide
CID 61114721
4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 107486111
5-amino-2-bromo-N-ethyl-4-fluoro-N-(2,2,2-trifluoroethyl)benzamide
CID 62814927

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide?
The IUPAC name of 5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide (CID 55006975) is 5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide?
The canonical SMILES for 5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide is CCN(CC(F)(F)F)C(=O)c1cc(N)cnc1C.
What is the InChIKey of 5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide?
The InChIKey is CKAKYMUBKKAYDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3O/c1-3-17(6-11(12,13)14)10(18)9-4-8(15)5-16-7(9)2/h4-5H,3,6,15H2,1-2H3.
What are the key properties of 5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide?
5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide has a molecular weight of 261.25 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide is sourced from PubChem (CID 55006975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).