4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide

C11H14F3N3O2 — CID 107486111

IUPAC4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
SMILESCc1cc(N)c(C(=O)N(CCO)CC(F)(F)F)cn1
InChIInChI=1S/C11H14F3N3O2/c1-7-4-9(15)8(5-16-7)10(19)17(2-3-18)6-11(12,13)14/h4-5,18H,2-3,6H2,1H3,(H2,15,16)
InChIKeyRSIZJPJQYKKNCE-UHFFFAOYSA-N
MW277.25 g/mol
LogP0.97
Rot. Bonds4

About 4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide

4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide (PubChem CID 107486111) has the molecular formula C11H14F3N3O2 and a molecular weight of 277.25 g/mol. Its IUPAC name is 4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
PubChem CID107486111
Molecular FormulaC11H14F3N3O2
Molecular Weight277.25 g/mol
Exact Mass277.10
IUPAC Name4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
SMILESCc1cc(N)c(C(=O)N(CCO)CC(F)(F)F)cn1
InChIInChI=1S/C11H14F3N3O2/c1-7-4-9(15)8(5-16-7)10(19)17(2-3-18)6-11(12,13)14/h4-5,18H,2-3,6H2,1H3,(H2,15,16)
InChIKeyRSIZJPJQYKKNCE-UHFFFAOYSA-N
XLogP0.97
TPSA79.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.25
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N,N-diethyl-6-methylpyridine-3-carboxamide
CID 81236376
4-chloro-6-methyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 81226727
4-amino-6-methyl-N,N-bis(3-methylbutyl)pyridine-3-carboxamide
CID 107871048
5-amino-N-(2-hydroxyethyl)-1-methyl-N-(2,2,2-trifluoroethyl)pyrazole-4-carboxamide
CID 104625736
3-amino-2,5-difluoro-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)benzamide
CID 107120758
2-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 61113881
2-chloro-5-fluoro-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 114034182
N-ethyl-6-methyl-4-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 81243054
4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)-6-methylpyridine-3-carboxamide
CID 81239796
N,N-bis(2-hydroxyethyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81243339
N-(2-hydroxyethyl)-6-methyl-4-oxo-N-(2,2,2-trifluoroethyl)-1H-pyridine-3-carboxamide
CID 103915507
4-amino-N-butyl-N,6-dimethylpyridine-3-carboxamide
CID 81234919

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide?
The IUPAC name of 4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide (CID 107486111) is 4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide?
The canonical SMILES for 4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide is Cc1cc(N)c(C(=O)N(CCO)CC(F)(F)F)cn1.
What is the InChIKey of 4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide?
The InChIKey is RSIZJPJQYKKNCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3O2/c1-7-4-9(15)8(5-16-7)10(19)17(2-3-18)6-11(12,13)14/h4-5,18H,2-3,6H2,1H3,(H2,15,16).
What are the key properties of 4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide?
4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide has a molecular weight of 277.25 g/mol, XLogP of 0.97, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-hydroxyethyl)-6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide is sourced from PubChem (CID 107486111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).