3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine

C8H16N4OS — CID 164648393

IUPAC3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine
SMILES[H]N=S(=O)(CC)Nc1cn(C)nc1CC
InChIInChI=1S/C8H16N4OS/c1-4-7-8(6-12(3)10-7)11-14(9,13)5-2/h6H,4-5H2,1-3H3,(H2,9,11,13)
InChIKeyKKLOPVRWFFWOEG-UHFFFAOYSA-N
MW216.31 g/mol
LogP1.38
Rot. Bonds4

About 3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine

3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine (PubChem CID 164648393) has the molecular formula C8H16N4OS and a molecular weight of 216.31 g/mol. Its IUPAC name is 3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine.

Molecular Properties

Compound Name3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine
PubChem CID164648393
Molecular FormulaC8H16N4OS
Molecular Weight216.31 g/mol
Exact Mass216.10
IUPAC Name3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine
SMILES[H]N=S(=O)(CC)Nc1cn(C)nc1CC
InChIInChI=1S/C8H16N4OS/c1-4-7-8(6-12(3)10-7)11-14(9,13)5-2/h6H,4-5H2,1-3H3,(H2,9,11,13)
InChIKeyKKLOPVRWFFWOEG-UHFFFAOYSA-N
XLogP1.38
TPSA70.77 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.31
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)ethanesulfonamide
CID 107462576
N-(3-ethyl-1-methylpyrazol-4-yl)-1-(methylamino)propane-2-sulfonamide
CID 106090358
(3-ethyl-1-methylpyrazol-4-yl)hydrazine
CID 107462607
4-amino-2,6-dibromo-N-(3-ethyl-1-methylpyrazol-4-yl)benzenesulfonamide
CID 107462048
3-[(3-ethyl-1-methylpyrazol-4-yl)sulfamoyl-methylamino]propanoic acid
CID 107462282
N-(3-ethyl-1-methylpyrazol-4-yl)-4-(2-hydroxyethyl)benzenesulfonamide
CID 106000585
5-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-2-methylbenzenesulfonamide
CID 107462000
4-[(3-ethyl-1-methylpyrazol-4-yl)sulfamoyl]benzenecarbothioamide
CID 107463279
2-chloro-N-(3-ethyl-1-methylpyrazol-4-yl)pyridine-4-sulfonamide
CID 107462605
N-(2,2-dimethylpropyl)-3-ethyl-1-methylpyrazol-4-amine
CID 115898031
4-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-2-fluorobenzenesulfonamide
CID 107461994
4-(aminomethyl)-N-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazole-5-sulfonamide
CID 106090355

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine?
The IUPAC name of 3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine (CID 164648393) is 3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine.
What is the SMILES notation for 3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine?
The canonical SMILES for 3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine is [H]N=S(=O)(CC)Nc1cn(C)nc1CC.
What is the InChIKey of 3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine?
The InChIKey is KKLOPVRWFFWOEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N4OS/c1-4-7-8(6-12(3)10-7)11-14(9,13)5-2/h6H,4-5H2,1-3H3,(H2,9,11,13).
What are the key properties of 3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine?
3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine has a molecular weight of 216.31 g/mol, XLogP of 1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(ethylsulfonimidoyl)-1-methylpyrazol-4-amine is sourced from PubChem (CID 164648393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).