N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide

C13H24N4O2S — CID 61437323

IUPACN-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide
SMILESCCC(CC)CN(CC)S(=O)(=O)c1ccnc(NN)c1
InChIInChI=1S/C13H24N4O2S/c1-4-11(5-2)10-17(6-3)20(18,19)12-7-8-15-13(9-12)16-14/h7-9,11H,4-6,10,14H2,1-3H3,(H,15,16)
InChIKeyXCYOJGNUIFRUPT-UHFFFAOYSA-N
MW300.43 g/mol
LogP1.81
Rot. Bonds8

About N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide

N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide (PubChem CID 61437323) has the molecular formula C13H24N4O2S and a molecular weight of 300.43 g/mol. Its IUPAC name is N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide.

Molecular Properties

Compound NameN-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide
PubChem CID61437323
Molecular FormulaC13H24N4O2S
Molecular Weight300.43 g/mol
Exact Mass300.16
IUPAC NameN-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide
SMILESCCC(CC)CN(CC)S(=O)(=O)c1ccnc(NN)c1
InChIInChI=1S/C13H24N4O2S/c1-4-11(5-2)10-17(6-3)20(18,19)12-7-8-15-13(9-12)16-14/h7-9,11H,4-6,10,14H2,1-3H3,(H,15,16)
InChIKeyXCYOJGNUIFRUPT-UHFFFAOYSA-N
XLogP1.81
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.43
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide?
The IUPAC name of N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide (CID 61437323) is N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide.
What is the SMILES notation for N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide?
The canonical SMILES for N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide is CCC(CC)CN(CC)S(=O)(=O)c1ccnc(NN)c1.
What is the InChIKey of N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide?
The InChIKey is XCYOJGNUIFRUPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2S/c1-4-11(5-2)10-17(6-3)20(18,19)12-7-8-15-13(9-12)16-14/h7-9,11H,4-6,10,14H2,1-3H3,(H,15,16).
What are the key properties of N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide?
N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide has a molecular weight of 300.43 g/mol, XLogP of 1.81, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-ethylbutyl)-2-hydrazinylpyridine-4-sulfonamide is sourced from PubChem (CID 61437323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).