2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide

C8H10F3N3O2S — CID 62146162

IUPAC2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide
SMILESCN(CC(F)(F)F)S(=O)(=O)c1cccnc1N
InChIInChI=1S/C8H10F3N3O2S/c1-14(5-8(9,10)11)17(15,16)6-3-2-4-13-7(6)12/h2-4H,5H2,1H3,(H2,12,13)
InChIKeyIVYPJBVTMSPTJN-UHFFFAOYSA-N
MW269.25 g/mol
LogP0.85
Rot. Bonds3

About 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide

2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide (PubChem CID 62146162) has the molecular formula C8H10F3N3O2S and a molecular weight of 269.25 g/mol. Its IUPAC name is 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide
PubChem CID62146162
Molecular FormulaC8H10F3N3O2S
Molecular Weight269.25 g/mol
Exact Mass269.04
IUPAC Name2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide
SMILESCN(CC(F)(F)F)S(=O)(=O)c1cccnc1N
InChIInChI=1S/C8H10F3N3O2S/c1-14(5-8(9,10)11)17(15,16)6-3-2-4-13-7(6)12/h2-4H,5H2,1H3,(H2,12,13)
InChIKeyIVYPJBVTMSPTJN-UHFFFAOYSA-N
XLogP0.85
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.25
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(2-hydroxy-2-methylpropyl)-N-methylpyridine-3-sulfonamide
CID 79381363
2-amino-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide
CID 65427020
2-[(2-amino-3-pyridinyl)sulfonyl-methylamino]-N,N-dimethylacetamide
CID 65427602
2-amino-N,N-diethylpyridine-3-sulfonamide
CID 62150875
2-amino-N-(5-hydroxypentyl)-N-methylpyridine-3-sulfonamide
CID 107197602
2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide
CID 62151896
2-amino-3-fluoro-N-methyl-N-(2,2,2-trifluoroethyl)benzenesulfonamide
CID 62058300
2-amino-N-methyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-sulfonamide
CID 64517173
2-amino-N-[2-(2-hydroxyethoxy)ethyl]-N-methylpyridine-3-sulfonamide
CID 114242959
2-amino-N-methyl-N-pyridin-2-ylpyridine-3-sulfonamide
CID 62149256
2-amino-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]pyridine-3-sulfonamide
CID 63234934
2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridine-3-sulfonamide
CID 62157082

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide?
The IUPAC name of 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide (CID 62146162) is 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide is CN(CC(F)(F)F)S(=O)(=O)c1cccnc1N.
What is the InChIKey of 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide?
The InChIKey is IVYPJBVTMSPTJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N3O2S/c1-14(5-8(9,10)11)17(15,16)6-3-2-4-13-7(6)12/h2-4H,5H2,1H3,(H2,12,13).
What are the key properties of 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide?
2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide has a molecular weight of 269.25 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 62146162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).