N-(1-ethoxypropan-2-yl)benzenesulfonamide

C11H17NO3S — CID 47957316

IUPACN-(1-ethoxypropan-2-yl)benzenesulfonamide
SMILESCCOCC(C)NS(=O)(=O)c1ccccc1
InChIInChI=1S/C11H17NO3S/c1-3-15-9-10(2)12-16(13,14)11-7-5-4-6-8-11/h4-8,10,12H,3,9H2,1-2H3
InChIKeyTURNOZACIIGXSB-UHFFFAOYSA-N
MW243.33 g/mol
LogP1.39
Rot. Bonds6

About N-(1-ethoxypropan-2-yl)benzenesulfonamide

N-(1-ethoxypropan-2-yl)benzenesulfonamide (PubChem CID 47957316) has the molecular formula C11H17NO3S and a molecular weight of 243.33 g/mol. Its IUPAC name is N-(1-ethoxypropan-2-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(1-ethoxypropan-2-yl)benzenesulfonamide
PubChem CID47957316
Molecular FormulaC11H17NO3S
Molecular Weight243.33 g/mol
Exact Mass243.09
IUPAC NameN-(1-ethoxypropan-2-yl)benzenesulfonamide
SMILESCCOCC(C)NS(=O)(=O)c1ccccc1
InChIInChI=1S/C11H17NO3S/c1-3-15-9-10(2)12-16(13,14)11-7-5-4-6-8-11/h4-8,10,12H,3,9H2,1-2H3
InChIKeyTURNOZACIIGXSB-UHFFFAOYSA-N
XLogP1.39
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-aminoethoxy)-N-(1-ethoxypropan-2-yl)benzenesulfonamide
CID 106054212
4-amino-3-chloro-N-(1-ethoxypropan-2-yl)benzenesulfonamide
CID 113288423
4-(aminomethyl)-N-(1-ethoxypropan-2-yl)-3-methylbenzenesulfonamide
CID 106919310
N-(1-ethoxypropan-2-yl)-4-ethyl-3-(methylaminomethyl)benzenesulfonamide
CID 106054288
N-(1-ethoxypropan-2-yl)-2-(propylaminomethyl)benzenesulfonamide
CID 106054391
N-(1-ethoxypropan-2-yl)-2-(ethylamino)pyridine-4-sulfonamide
CID 62158252
3-(aminomethyl)-N-(1-ethoxypropan-2-yl)-4-fluorobenzenesulfonamide
CID 63288410
3-amino-4-(1-ethoxypropan-2-ylsulfamoyl)benzoic acid
CID 81471128
3-chloro-4-cyano-N-(1-ethoxypropan-2-yl)benzenesulfonamide
CID 112686588
1-O-[2-(benzenesulfonamido)propyl] 4-O-propan-2-yl (E)-but-2-enedioate
CID 126491717
N-(1-ethoxypropan-2-yl)-2-(propylamino)pyrimidine-5-sulfonamide
CID 62158251
5-chloro-N-(1-ethoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64608286

Frequently Asked Questions

What is the IUPAC name of N-(1-ethoxypropan-2-yl)benzenesulfonamide?
The IUPAC name of N-(1-ethoxypropan-2-yl)benzenesulfonamide (CID 47957316) is N-(1-ethoxypropan-2-yl)benzenesulfonamide.
What is the SMILES notation for N-(1-ethoxypropan-2-yl)benzenesulfonamide?
The canonical SMILES for N-(1-ethoxypropan-2-yl)benzenesulfonamide is CCOCC(C)NS(=O)(=O)c1ccccc1.
What is the InChIKey of N-(1-ethoxypropan-2-yl)benzenesulfonamide?
The InChIKey is TURNOZACIIGXSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3S/c1-3-15-9-10(2)12-16(13,14)11-7-5-4-6-8-11/h4-8,10,12H,3,9H2,1-2H3.
What are the key properties of N-(1-ethoxypropan-2-yl)benzenesulfonamide?
N-(1-ethoxypropan-2-yl)benzenesulfonamide has a molecular weight of 243.33 g/mol, XLogP of 1.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethoxypropan-2-yl)benzenesulfonamide is sourced from PubChem (CID 47957316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).