N-(2-ethylbutyl)-4-propylbenzenesulfonamide

C15H25NO2S — CID 115613302

IUPACN-(2-ethylbutyl)-4-propylbenzenesulfonamide
SMILESCCCc1ccc(S(=O)(=O)NCC(CC)CC)cc1
InChIInChI=1S/C15H25NO2S/c1-4-7-14-8-10-15(11-9-14)19(17,18)16-12-13(5-2)6-3/h8-11,13,16H,4-7,12H2,1-3H3
InChIKeyAQKYEEPSXOVSLO-UHFFFAOYSA-N
MW283.44 g/mol
LogP3.35
Rot. Bonds8

About N-(2-ethylbutyl)-4-propylbenzenesulfonamide

N-(2-ethylbutyl)-4-propylbenzenesulfonamide (PubChem CID 115613302) has the molecular formula C15H25NO2S and a molecular weight of 283.44 g/mol. Its IUPAC name is N-(2-ethylbutyl)-4-propylbenzenesulfonamide.

Molecular Properties

Compound NameN-(2-ethylbutyl)-4-propylbenzenesulfonamide
PubChem CID115613302
Molecular FormulaC15H25NO2S
Molecular Weight283.44 g/mol
Exact Mass283.16
IUPAC NameN-(2-ethylbutyl)-4-propylbenzenesulfonamide
SMILESCCCc1ccc(S(=O)(=O)NCC(CC)CC)cc1
InChIInChI=1S/C15H25NO2S/c1-4-7-14-8-10-15(11-9-14)19(17,18)16-12-13(5-2)6-3/h8-11,13,16H,4-7,12H2,1-3H3
InChIKeyAQKYEEPSXOVSLO-UHFFFAOYSA-N
XLogP3.35
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.44
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-hydroxypropyl)-4-propylbenzenesulfonamide
CID 3391675
4-N-(2-ethylbutyl)benzene-1,4-disulfonamide
CID 115613409
4-(aminomethyl)-N-(2-ethylhexyl)benzenesulfonamide
CID 107816801
N-(2-ethylbutyl)-4-(trifluoromethyl)benzenesulfonamide
CID 115613428
N-iodo-4-propylbenzenesulfonamide
CID 143564822
N-(2-ethylbutyl)-3,4-dimethylbenzenesulfonamide
CID 84512808
4-(2-chloroethyl)-N-(2-methylbutyl)benzenesulfonamide
CID 62694206
N-[2-(dimethylamino)-3-phenylpropyl]-4-propylbenzenesulfonamide
CID 55353812
N-[2-(2-hydroxypropylamino)ethyl]-4-propylbenzenesulfonamide
CID 104594124
N-(2-methylprop-2-enyl)-4-propylbenzenesulfonamide
CID 114616423
N-(3-aminopropyl)-4-propylbenzenesulfonamide
CID 43605819
6-chloro-N-(2-ethylbutyl)pyridine-3-sulfonamide
CID 115613422

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylbutyl)-4-propylbenzenesulfonamide?
The IUPAC name of N-(2-ethylbutyl)-4-propylbenzenesulfonamide (CID 115613302) is N-(2-ethylbutyl)-4-propylbenzenesulfonamide.
What is the SMILES notation for N-(2-ethylbutyl)-4-propylbenzenesulfonamide?
The canonical SMILES for N-(2-ethylbutyl)-4-propylbenzenesulfonamide is CCCc1ccc(S(=O)(=O)NCC(CC)CC)cc1.
What is the InChIKey of N-(2-ethylbutyl)-4-propylbenzenesulfonamide?
The InChIKey is AQKYEEPSXOVSLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2S/c1-4-7-14-8-10-15(11-9-14)19(17,18)16-12-13(5-2)6-3/h8-11,13,16H,4-7,12H2,1-3H3.
What are the key properties of N-(2-ethylbutyl)-4-propylbenzenesulfonamide?
N-(2-ethylbutyl)-4-propylbenzenesulfonamide has a molecular weight of 283.44 g/mol, XLogP of 3.35, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylbutyl)-4-propylbenzenesulfonamide is sourced from PubChem (CID 115613302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).