4-amino-N-cyclodecylbenzenesulfonamide

C16H26N2O2S — CID 90455423

IUPAC4-amino-N-cyclodecylbenzenesulfonamide
SMILESNc1ccc(S(=O)(=O)NC2CCCCCCCCC2)cc1
InChIInChI=1S/C16H26N2O2S/c17-14-10-12-16(13-11-14)21(19,20)18-15-8-6-4-2-1-3-5-7-9-15/h10-13,15,18H,1-9,17H2
InChIKeyKHKQQBONKQDICQ-UHFFFAOYSA-N
MW310.46 g/mol
LogP3.44
Rot. Bonds3

About 4-amino-N-cyclodecylbenzenesulfonamide

4-amino-N-cyclodecylbenzenesulfonamide (PubChem CID 90455423) has the molecular formula C16H26N2O2S and a molecular weight of 310.46 g/mol. Its IUPAC name is 4-amino-N-cyclodecylbenzenesulfonamide.

Molecular Properties

Compound Name4-amino-N-cyclodecylbenzenesulfonamide
PubChem CID90455423
Molecular FormulaC16H26N2O2S
Molecular Weight310.46 g/mol
Exact Mass310.17
IUPAC Name4-amino-N-cyclodecylbenzenesulfonamide
SMILESNc1ccc(S(=O)(=O)NC2CCCCCCCCC2)cc1
InChIInChI=1S/C16H26N2O2S/c17-14-10-12-16(13-11-14)21(19,20)18-15-8-6-4-2-1-3-5-7-9-15/h10-13,15,18H,1-9,17H2
InChIKeyKHKQQBONKQDICQ-UHFFFAOYSA-N
XLogP3.44
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.46
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-(2-aminoethyl)-N-cyclohexylbenzenesulfonamide
CID 16643216
4-(aminomethyl)-N-cyclohexylbenzenesulfonamide
CID 16781327
4-(1-aminoethyl)-N-cycloheptylbenzenesulfonamide
CID 43167801
N-cyclopentyl-4-propan-2-ylbenzenesulfonamide
CID 6469335
N-cycloheptyl-4-(methylamino)benzenesulfonamide
CID 15049673
2-[(4-aminophenyl)sulfonylamino]ethyl N-cyclohexylsulfamate
CID 21312723
1-N-cyclohexyl-4-N,4-N-dimethylbenzene-1,4-disulfonamide
CID 859646
4-amino-N-(1-tert-butylpiperidin-4-yl)benzenesulfonamide
CID 61125705
sodium 4-(cyclohexylsulfamoyl)benzoate
CID 122705986
4-(azepan-1-ylsulfonyl)-N-cyclohexylbenzenesulfonamide
CID 1167072
3-amino-N-cycloheptyl-4-ethylbenzenesulfonamide
CID 43258911
N-cyclooctyl-4-(ethylamino)benzenesulfonamide
CID 62150101

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclodecylbenzenesulfonamide?
The IUPAC name of 4-amino-N-cyclodecylbenzenesulfonamide (CID 90455423) is 4-amino-N-cyclodecylbenzenesulfonamide.
What is the SMILES notation for 4-amino-N-cyclodecylbenzenesulfonamide?
The canonical SMILES for 4-amino-N-cyclodecylbenzenesulfonamide is Nc1ccc(S(=O)(=O)NC2CCCCCCCCC2)cc1.
What is the InChIKey of 4-amino-N-cyclodecylbenzenesulfonamide?
The InChIKey is KHKQQBONKQDICQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2S/c17-14-10-12-16(13-11-14)21(19,20)18-15-8-6-4-2-1-3-5-7-9-15/h10-13,15,18H,1-9,17H2.
What are the key properties of 4-amino-N-cyclodecylbenzenesulfonamide?
4-amino-N-cyclodecylbenzenesulfonamide has a molecular weight of 310.46 g/mol, XLogP of 3.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclodecylbenzenesulfonamide is sourced from PubChem (CID 90455423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).