4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide

C14H17N3O2S — CID 43454992

IUPAC4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide
SMILESNNc1ccc(S(=O)(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C14H17N3O2S/c15-17-13-6-8-14(9-7-13)20(18,19)16-11-10-12-4-2-1-3-5-12/h1-9,16-17H,10-11,15H2
InChIKeyZJFRFOYXHAIDIC-UHFFFAOYSA-N
MW291.38 g/mol
LogP1.49
Rot. Bonds6

About 4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide

4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide (PubChem CID 43454992) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is 4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide.

Molecular Properties

Compound Name4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide
PubChem CID43454992
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC Name4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide
SMILESNNc1ccc(S(=O)(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C14H17N3O2S/c15-17-13-6-8-14(9-7-13)20(18,19)16-11-10-12-4-2-1-3-5-12/h1-9,16-17H,10-11,15H2
InChIKeyZJFRFOYXHAIDIC-UHFFFAOYSA-N
XLogP1.49
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 51.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

4-(benzenesulfonamido)-N-(2-phenylethyl)benzenesulfonamide
CID 5222462
N-[2-(3-fluorophenyl)ethyl]-4-hydrazinylbenzenesulfonamide
CID 43566343
4-hydrazinyl-N-[2-(4-methoxyphenyl)ethyl]benzenesulfonamide
CID 19844131
4-nitro-N-(2-phenylethyl)benzenesulfonamide
CID 682201
4-methylsulfanyl-N-(2-phenylethyl)benzenesulfonamide
CID 961989
4-hydrazinyl-N-[2-(methanesulfonamido)ethyl]benzenesulfonamide
CID 43546298
ethyl 2-oxo-2-[4-(2-phenylethylsulfamoyl)anilino]acetate
CID 2188314
2-cyano-N-[4-(2-phenylethylsulfamoyl)phenyl]acetamide
CID 168522081
acetonitrile;4-chloro-N-(2-phenylethyl)benzenesulfonamide;hydrate
CID 174293454
4-amino-3-fluoro-N-(2-phenylethyl)benzenesulfonamide
CID 82844764
3-[(4-bromophenyl)sulfonylamino]-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide
CID 17192480
2-phenoxy-N-[4-(2-phenylethylsulfamoyl)phenyl]acetamide
CID 5187425

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide?
The IUPAC name of 4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide (CID 43454992) is 4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide.
What is the SMILES notation for 4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide?
The canonical SMILES for 4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide is NNc1ccc(S(=O)(=O)NCCc2ccccc2)cc1.
What is the InChIKey of 4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide?
The InChIKey is ZJFRFOYXHAIDIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c15-17-13-6-8-14(9-7-13)20(18,19)16-11-10-12-4-2-1-3-5-12/h1-9,16-17H,10-11,15H2.
What are the key properties of 4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide?
4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide has a molecular weight of 291.38 g/mol, XLogP of 1.49, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide is sourced from PubChem (CID 43454992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).