2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide

C11H19N3O5S2 — CID 102699204

IUPAC2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide
SMILESCOC(C)CNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1NN
InChIInChI=1S/C11H19N3O5S2/c1-8(19-2)7-13-21(17,18)11-6-9(20(3,15)16)4-5-10(11)14-12/h4-6,8,13-14H,7,12H2,1-3H3
InChIKeyFWILDDWUWHGFIU-UHFFFAOYSA-N
MW337.42 g/mol
LogP-0.31
Rot. Bonds7

About 2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide

2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide (PubChem CID 102699204) has the molecular formula C11H19N3O5S2 and a molecular weight of 337.42 g/mol. Its IUPAC name is 2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide.

Molecular Properties

Compound Name2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide
PubChem CID102699204
Molecular FormulaC11H19N3O5S2
Molecular Weight337.42 g/mol
Exact Mass337.08
IUPAC Name2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide
SMILESCOC(C)CNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1NN
InChIInChI=1S/C11H19N3O5S2/c1-8(19-2)7-13-21(17,18)11-6-9(20(3,15)16)4-5-10(11)14-12/h4-6,8,13-14H,7,12H2,1-3H3
InChIKeyFWILDDWUWHGFIU-UHFFFAOYSA-N
XLogP-0.31
TPSA127.59 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 5-0.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-butan-2-yl-2-hydrazinyl-N-methyl-5-methylsulfonylbenzenesulfonamide
CID 43455184
4-(ethylamino)-N-(2-methoxypropyl)-3-nitrobenzenesulfonamide
CID 102700446
2-hydrazinyl-N-(2-methylpropyl)-5-nitrobenzenesulfonamide
CID 43325298
5-(aminomethyl)-N-(2-methoxypropyl)-2,3-dimethylbenzenesulfonamide
CID 102701453
3-chloro-4-cyano-N-(2-methoxypropyl)benzenesulfonamide
CID 102697592
2-amino-4-cyano-N-(2-methoxypropyl)benzenesulfonamide
CID 102694330
2-amino-N-(2-methoxypropyl)pyrimidine-5-sulfonamide
CID 102700480
3-fluoro-N-(2-methoxypropyl)benzenesulfonamide
CID 102697449
2-fluoro-N-[(2R)-2-hydroxypropyl]-5-methylsulfonylbenzenesulfonamide
CID 83058758
N-(2-methoxypropyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
CID 102697434
4-(chloromethyl)-N-(2-methoxypropyl)-3-methylbenzenesulfonamide
CID 112737391
N-(2-methoxypropyl)-3-methyl-4-propan-2-yloxybenzenesulfonamide
CID 102697438

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide?
The IUPAC name of 2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide (CID 102699204) is 2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide.
What is the SMILES notation for 2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide?
The canonical SMILES for 2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide is COC(C)CNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1NN.
What is the InChIKey of 2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide?
The InChIKey is FWILDDWUWHGFIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O5S2/c1-8(19-2)7-13-21(17,18)11-6-9(20(3,15)16)4-5-10(11)14-12/h4-6,8,13-14H,7,12H2,1-3H3.
What are the key properties of 2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide?
2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide has a molecular weight of 337.42 g/mol, XLogP of -0.31, 7 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(2-methoxypropyl)-5-methylsulfonylbenzenesulfonamide is sourced from PubChem (CID 102699204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).