N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide

C9H17N5O4S2 — CID 106340166

IUPACN-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide
SMILESCCNS(=O)(=O)CCNS(=O)(=O)c1cccnc1NN
InChIInChI=1S/C9H17N5O4S2/c1-2-12-19(15,16)7-6-13-20(17,18)8-4-3-5-11-9(8)14-10/h3-5,12-13H,2,6-7,10H2,1H3,(H,11,14)
InChIKeyFYCSJNMVBODVFX-UHFFFAOYSA-N
MW323.40 g/mol
LogP-1.42
Rot. Bonds8

About N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide

N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide (PubChem CID 106340166) has the molecular formula C9H17N5O4S2 and a molecular weight of 323.40 g/mol. Its IUPAC name is N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide
PubChem CID106340166
Molecular FormulaC9H17N5O4S2
Molecular Weight323.40 g/mol
Exact Mass323.07
IUPAC NameN-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide
SMILESCCNS(=O)(=O)CCNS(=O)(=O)c1cccnc1NN
InChIInChI=1S/C9H17N5O4S2/c1-2-12-19(15,16)7-6-13-20(17,18)8-4-3-5-11-9(8)14-10/h3-5,12-13H,2,6-7,10H2,1H3,(H,11,14)
InChIKeyFYCSJNMVBODVFX-UHFFFAOYSA-N
XLogP-1.42
TPSA143.28 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 5-1.42
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[ethyl(methyl)amino]ethyl]-2-hydrazinylpyridine-3-sulfonamide
CID 62635837
3-amino-N-[2-(ethylsulfamoyl)ethyl]pyridine-2-sulfonamide
CID 106342302
N-[(2-ethylphenyl)methyl]-2-hydrazinylpyridine-3-sulfonamide
CID 64694908
N-[2-(ethylsulfamoyl)ethyl]-3-fluoropyridine-2-sulfonamide
CID 114175137
2-amino-N-[2-(ethylsulfamoyl)ethyl]-3-fluorobenzenesulfonamide
CID 106333459
2-[(2-hydrazinyl-3-pyridinyl)sulfonylamino]acetamide
CID 43545765
2-hydrazinyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-3-sulfonamide
CID 106419522
2-(ethylamino)-N-pentylpyridine-3-sulfonamide
CID 62162989
3-[(2-hydrazinyl-3-pyridinyl)sulfonylamino]-2,2-dimethylpropanamide
CID 106278324
N-(2-ethylphenyl)-2-hydrazinylpyridine-3-sulfonamide
CID 43456850
2-hydrazinyl-N-[(2-methylpyrazol-3-yl)methyl]pyridine-3-sulfonamide
CID 63303237
2-hydrazinyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-3-sulfonamide
CID 62848316

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide?
The IUPAC name of N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide (CID 106340166) is N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide.
What is the SMILES notation for N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide?
The canonical SMILES for N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide is CCNS(=O)(=O)CCNS(=O)(=O)c1cccnc1NN.
What is the InChIKey of N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide?
The InChIKey is FYCSJNMVBODVFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5O4S2/c1-2-12-19(15,16)7-6-13-20(17,18)8-4-3-5-11-9(8)14-10/h3-5,12-13H,2,6-7,10H2,1H3,(H,11,14).
What are the key properties of N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide?
N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide has a molecular weight of 323.40 g/mol, XLogP of -1.42, 8 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylsulfamoyl)ethyl]-2-hydrazinylpyridine-3-sulfonamide is sourced from PubChem (CID 106340166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).