4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide

C11H15N3O2S — CID 139083383

IUPAC4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(NN=C2CCCC2)cc1
InChIInChI=1S/C11H15N3O2S/c12-17(15,16)11-7-5-10(6-8-11)14-13-9-3-1-2-4-9/h5-8,14H,1-4H2,(H2,12,15,16)
InChIKeyVJYDRCLTKZXTNI-UHFFFAOYSA-N
MW253.33 g/mol
LogP1.68
Rot. Bonds3

About 4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide

4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide (PubChem CID 139083383) has the molecular formula C11H15N3O2S and a molecular weight of 253.33 g/mol. Its IUPAC name is 4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide.

Molecular Properties

Compound Name4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide
PubChem CID139083383
Molecular FormulaC11H15N3O2S
Molecular Weight253.33 g/mol
Exact Mass253.09
IUPAC Name4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(NN=C2CCCC2)cc1
InChIInChI=1S/C11H15N3O2S/c12-17(15,16)11-7-5-10(6-8-11)14-13-9-3-1-2-4-9/h5-8,14H,1-4H2,(H2,12,15,16)
InChIKeyVJYDRCLTKZXTNI-UHFFFAOYSA-N
XLogP1.68
TPSA84.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.33
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-[2-(4-tert-butylcyclohexylidene)hydrazinyl]benzenesulfonamide
CID 3657005
disodium;4-[2-[4-[(4-sulfonatophenyl)hydrazinylidene]cyclohexylidene]hydrazinyl]benzenesulfonate
CID 2831877
4-bromo-N-(cyclohexylideneamino)aniline
CID 4167253
methyl 2-[(1S,2Z)-2-[(4-sulfamoylphenyl)hydrazinylidene]cyclohexyl]acetate
CID 7689704
[(4E)-4-[[4-(benzenesulfonyl)phenyl]hydrazinylidene]azepan-1-yl]-phenylmethanone
CID 87930845
2-[(4-sulfamoylphenyl)carbamoyl]cyclohexene-1-carboxylic acid
CID 53270897
N-(4-sulfamoylphenyl)piperidine-1-carbothioamide
CID 19653686
(1E)-2-oxo-2-pyrrolidin-1-yl-N-(4-sulfamoylanilino)ethanimidoyl cyanide
CID 134103700
(4-sulfamoylanilino)azanium chloride
CID 2736519
4-[(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]benzenesulfonamide
CID 7066751
4-[2-[(2-hydroxyphenyl)methylidene]hydrazinyl]benzenesulfonamide
CID 4850995
N-(4-sulfamoylphenyl)azocane-1-carboxamide
CID 17414007

Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide?
The IUPAC name of 4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide (CID 139083383) is 4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide.
What is the SMILES notation for 4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide?
The canonical SMILES for 4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide is NS(=O)(=O)c1ccc(NN=C2CCCC2)cc1.
What is the InChIKey of 4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide?
The InChIKey is VJYDRCLTKZXTNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2S/c12-17(15,16)11-7-5-10(6-8-11)14-13-9-3-1-2-4-9/h5-8,14H,1-4H2,(H2,12,15,16).
What are the key properties of 4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide?
4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide has a molecular weight of 253.33 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide is sourced from PubChem (CID 139083383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).