N-benzyl-N-ethylbenzenesulfonamide

C15H17NO2S — CID 668950

IUPACN-benzyl-N-ethylbenzenesulfonamide
SMILESCCN(Cc1ccccc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C15H17NO2S/c1-2-16(13-14-9-5-3-6-10-14)19(17,18)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3
InChIKeyIVRVDQCUNWLFDT-UHFFFAOYSA-N
MW275.37 g/mol
LogP2.90
Rot. Bonds5

About N-benzyl-N-ethylbenzenesulfonamide

N-benzyl-N-ethylbenzenesulfonamide (PubChem CID 668950) has the molecular formula C15H17NO2S and a molecular weight of 275.37 g/mol. Its IUPAC name is N-benzyl-N-ethylbenzenesulfonamide.

Molecular Properties

Compound NameN-benzyl-N-ethylbenzenesulfonamide
PubChem CID668950
Molecular FormulaC15H17NO2S
Molecular Weight275.37 g/mol
Exact Mass275.10
IUPAC NameN-benzyl-N-ethylbenzenesulfonamide
SMILESCCN(Cc1ccccc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C15H17NO2S/c1-2-16(13-14-9-5-3-6-10-14)19(17,18)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3
InChIKeyIVRVDQCUNWLFDT-UHFFFAOYSA-N
XLogP2.90
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,4-N-dibenzyl-4-N-ethyl-1-N-methylbenzene-1,4-disulfonamide
CID 1167043
N-benzyl-N-ethyl-3,4-dimethylbenzenesulfonamide
CID 35767176
N-benzyl-N-[2-(dimethylamino)ethyl]benzenesulfonamide
CID 54184847
2-[benzenesulfonyl(benzyl)amino]-N,N-diethylacetamide
CID 4780411
N-benzyl-N-ethyl-3-nitrobenzenesulfonamide
CID 39847517
N,N-dibenzyl-4-methoxybenzenesulfonamide
CID 1005048
N,N'-dibenzyl-N,N'-diethylmethanedisulfonamide
CID 90121532
methyl 3-[benzyl(ethyl)sulfamoyl]benzoate
CID 31701224
N-benzyl-N-(2-hydroxyethyl)benzenesulfonamide
CID 668951
N-benzyl-N-(2-chloroethyl)benzenesulfonamide
CID 14170856
N-(2-amino-2-methylpropyl)-N-benzylbenzenesulfonamide
CID 91136182
N-benzyl-4-(2,6-dimethylpiperidin-1-yl)sulfonyl-N-ethylbenzenesulfonamide
CID 3226867

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethylbenzenesulfonamide?
The IUPAC name of N-benzyl-N-ethylbenzenesulfonamide (CID 668950) is N-benzyl-N-ethylbenzenesulfonamide.
What is the SMILES notation for N-benzyl-N-ethylbenzenesulfonamide?
The canonical SMILES for N-benzyl-N-ethylbenzenesulfonamide is CCN(Cc1ccccc1)S(=O)(=O)c1ccccc1.
What is the InChIKey of N-benzyl-N-ethylbenzenesulfonamide?
The InChIKey is IVRVDQCUNWLFDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2S/c1-2-16(13-14-9-5-3-6-10-14)19(17,18)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3.
What are the key properties of N-benzyl-N-ethylbenzenesulfonamide?
N-benzyl-N-ethylbenzenesulfonamide has a molecular weight of 275.37 g/mol, XLogP of 2.90, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethylbenzenesulfonamide is sourced from PubChem (CID 668950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).