N-nonan-4-ylbenzenesulfonamide

C15H25NO2S — CID 174769116

IUPACN-nonan-4-ylbenzenesulfonamide
SMILESCCCCCC(CCC)NS(=O)(=O)c1ccccc1
InChIInChI=1S/C15H25NO2S/c1-3-5-7-11-14(10-4-2)16-19(17,18)15-12-8-6-9-13-15/h6,8-9,12-14,16H,3-5,7,10-11H2,1-2H3
InChIKeyBYKKTUHDVPKTLD-UHFFFAOYSA-N
MW283.44 g/mol
LogP3.71
Rot. Bonds9

About N-nonan-4-ylbenzenesulfonamide

N-nonan-4-ylbenzenesulfonamide (PubChem CID 174769116) has the molecular formula C15H25NO2S and a molecular weight of 283.44 g/mol. Its IUPAC name is N-nonan-4-ylbenzenesulfonamide.

Molecular Properties

Compound NameN-nonan-4-ylbenzenesulfonamide
PubChem CID174769116
Molecular FormulaC15H25NO2S
Molecular Weight283.44 g/mol
Exact Mass283.16
IUPAC NameN-nonan-4-ylbenzenesulfonamide
SMILESCCCCCC(CCC)NS(=O)(=O)c1ccccc1
InChIInChI=1S/C15H25NO2S/c1-3-5-7-11-14(10-4-2)16-19(17,18)15-12-8-6-9-13-15/h6,8-9,12-14,16H,3-5,7,10-11H2,1-2H3
InChIKeyBYKKTUHDVPKTLD-UHFFFAOYSA-N
XLogP3.71
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.44
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-nonan-4-ylbenzenesulfonamide 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-(1-aminohexan-2-yl)benzenesulfonamide;hydrochloride
CID 119993034
4-methyl-N-octan-3-ylbenzenesulfonamide
CID 11822147
2-bromo-N-octan-4-ylbenzenesulfonamide
CID 106025735
N-[1-(N-ethylanilino)decan-2-yl]-4-methylbenzenesulfonamide
CID 11750792
N-(2-methylheptyl)benzenesulfonamide
CID 143260336
4-methyl-N-[(2S)-1-phenylpentan-2-yl]benzenesulfonamide
CID 45102181
N-(1-chlorononan-2-yl)-4-methylbenzenesulfonamide
CID 25268981
N-(1-oxopentan-2-yl)benzenesulfonamide
CID 174520678
N-(1-pyridin-2-yltridecyl)benzenesulfonamide
CID 54173262
4-methyl-N-[(2R)-2-[(4-methylphenyl)sulfonylamino]octyl]benzenesulfonamide
CID 101389381
N-(1,3-difluoropropan-2-yl)benzenesulfonamide
CID 67606525
2-amino-N-octan-4-ylpyrimidine-5-sulfonamide
CID 106027708

Frequently Asked Questions

What is the IUPAC name of N-nonan-4-ylbenzenesulfonamide?
The IUPAC name of N-nonan-4-ylbenzenesulfonamide (CID 174769116) is N-nonan-4-ylbenzenesulfonamide.
What is the SMILES notation for N-nonan-4-ylbenzenesulfonamide?
The canonical SMILES for N-nonan-4-ylbenzenesulfonamide is CCCCCC(CCC)NS(=O)(=O)c1ccccc1.
What is the InChIKey of N-nonan-4-ylbenzenesulfonamide?
The InChIKey is BYKKTUHDVPKTLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2S/c1-3-5-7-11-14(10-4-2)16-19(17,18)15-12-8-6-9-13-15/h6,8-9,12-14,16H,3-5,7,10-11H2,1-2H3.
What are the key properties of N-nonan-4-ylbenzenesulfonamide?
N-nonan-4-ylbenzenesulfonamide has a molecular weight of 283.44 g/mol, XLogP of 3.71, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-nonan-4-ylbenzenesulfonamide is sourced from PubChem (CID 174769116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).