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

C12H19N3O3S — CID 62360200

IUPAC4-hydrazinyl-N-(2-hydroxycyclohexyl)benzenesulfonamide
SMILESNNc1ccc(S(=O)(=O)NC2CCCCC2O)cc1
InChIInChI=1S/C12H19N3O3S/c13-14-9-5-7-10(8-6-9)19(17,18)15-11-3-1-2-4-12(11)16/h5-8,11-12,14-16H,1-4,13H2
InChIKeySMEMEGDPAUQMGK-UHFFFAOYSA-N
MW285.37 g/mol
LogP0.55
Rot. Bonds4

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

4-hydrazinyl-N-(2-hydroxycyclohexyl)benzenesulfonamide (PubChem CID 62360200) has the molecular formula C12H19N3O3S and a molecular weight of 285.37 g/mol. Its IUPAC name is 4-hydrazinyl-N-(2-hydroxycyclohexyl)benzenesulfonamide.

Molecular Properties

Compound Name4-hydrazinyl-N-(2-hydroxycyclohexyl)benzenesulfonamide
PubChem CID62360200
Molecular FormulaC12H19N3O3S
Molecular Weight285.37 g/mol
Exact Mass285.11
IUPAC Name4-hydrazinyl-N-(2-hydroxycyclohexyl)benzenesulfonamide
SMILESNNc1ccc(S(=O)(=O)NC2CCCCC2O)cc1
InChIInChI=1S/C12H19N3O3S/c13-14-9-5-7-10(8-6-9)19(17,18)15-11-3-1-2-4-12(11)16/h5-8,11-12,14-16H,1-4,13H2
InChIKeySMEMEGDPAUQMGK-UHFFFAOYSA-N
XLogP0.55
TPSA104.45 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 50.55
H-Bond Donors ≤ 54
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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Related Compounds

N-[4-[[(1S,2S)-2-hydroxycyclohexyl]sulfamoyl]phenyl]acetamide
CID 27059218
N-[(1S,2S)-2-hydroxycyclohexyl]-4-methylsulfonylbenzenesulfonamide
CID 104953140
4-(ethylamino)-N-(2-hydroxycyclohexyl)benzenesulfonamide
CID 62360398
3-amino-4-bromo-N-(2-hydroxycyclohexyl)benzenesulfonamide
CID 115329229
4-fluoro-N-[(1S,2S)-2-hydroxycyclopentyl]benzenesulfonamide
CID 40650403
N-[(1R,2R)-2-hydroxycyclopentyl]-4-methylbenzenesulfonamide
CID 11230584
N-[(1S,2R)-2-hydroxycyclohexyl]-4-nitrobenzenesulfonamide
CID 40617850
4-(cyanomethyl)-N-[(1R,2R)-2-hydroxycyclohexyl]benzenesulfonamide
CID 104922414
4-amino-3-fluoro-N-(2-hydroxycyclohexyl)benzenesulfonamide
CID 82844106
4-amino-3-fluoro-N-[(1R,2R)-2-hydroxycyclohexyl]benzenesulfonamide
CID 107213611
N-[(1R,2R)-2-hydroxycyclohexyl]-4-(trifluoromethoxy)benzenesulfonamide
CID 155061379
3-bromo-4-chloro-N-(2-hydroxycyclohexyl)benzenesulfonamide
CID 106546192

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-(2-hydroxycyclohexyl)benzenesulfonamide?
The IUPAC name of 4-hydrazinyl-N-(2-hydroxycyclohexyl)benzenesulfonamide (CID 62360200) is 4-hydrazinyl-N-(2-hydroxycyclohexyl)benzenesulfonamide.
What is the SMILES notation for 4-hydrazinyl-N-(2-hydroxycyclohexyl)benzenesulfonamide?
The canonical SMILES for 4-hydrazinyl-N-(2-hydroxycyclohexyl)benzenesulfonamide is NNc1ccc(S(=O)(=O)NC2CCCCC2O)cc1.
What is the InChIKey of 4-hydrazinyl-N-(2-hydroxycyclohexyl)benzenesulfonamide?
The InChIKey is SMEMEGDPAUQMGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3S/c13-14-9-5-7-10(8-6-9)19(17,18)15-11-3-1-2-4-12(11)16/h5-8,11-12,14-16H,1-4,13H2.
What are the key properties of 4-hydrazinyl-N-(2-hydroxycyclohexyl)benzenesulfonamide?
4-hydrazinyl-N-(2-hydroxycyclohexyl)benzenesulfonamide has a molecular weight of 285.37 g/mol, XLogP of 0.55, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-(2-hydroxycyclohexyl)benzenesulfonamide is sourced from PubChem (CID 62360200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).