N-benzyl-N-(2-hydroxyethyl)methanesulfonamide

C10H15NO3S — CID 3329134

IUPACN-benzyl-N-(2-hydroxyethyl)methanesulfonamide
SMILESCS(=O)(=O)N(CCO)Cc1ccccc1
InChIInChI=1S/C10H15NO3S/c1-15(13,14)11(7-8-12)9-10-5-3-2-4-6-10/h2-6,12H,7-9H2,1H3
InChIKeyJIKFKPWBLFMOPE-UHFFFAOYSA-N
MW229.30 g/mol
LogP0.44
Rot. Bonds5

About N-benzyl-N-(2-hydroxyethyl)methanesulfonamide

N-benzyl-N-(2-hydroxyethyl)methanesulfonamide (PubChem CID 3329134) has the molecular formula C10H15NO3S and a molecular weight of 229.30 g/mol. Its IUPAC name is N-benzyl-N-(2-hydroxyethyl)methanesulfonamide.

Molecular Properties

Compound NameN-benzyl-N-(2-hydroxyethyl)methanesulfonamide
PubChem CID3329134
Molecular FormulaC10H15NO3S
Molecular Weight229.30 g/mol
Exact Mass229.08
IUPAC NameN-benzyl-N-(2-hydroxyethyl)methanesulfonamide
SMILESCS(=O)(=O)N(CCO)Cc1ccccc1
InChIInChI=1S/C10H15NO3S/c1-15(13,14)11(7-8-12)9-10-5-3-2-4-6-10/h2-6,12H,7-9H2,1H3
InChIKeyJIKFKPWBLFMOPE-UHFFFAOYSA-N
XLogP0.44
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-(2-hydroxyethyl)benzenesulfonamide
CID 668951
N-benzyl-2-hydroxy-N-(2-hydroxyethyl)benzenesulfonamide
CID 81233797
N-benzyl-N-(2-ethylsulfanylethyl)methanesulfonamide
CID 75448253
3-[benzyl(methylsulfonyl)amino]-N,N-diethylpropanamide
CID 113138656
2-[benzyl(methylsulfonyl)amino]acetyl chloride
CID 50894323
3-[benzyl(methylsulfonyl)amino]-N-methyl-N-phenylpropanamide
CID 113138673
N,N-dibenzyl-2-[benzyl(methylsulfonyl)amino]acetamide
CID 126109198
ethyl N-[2-[benzyl(methylsulfonyl)amino]ethyl]carbamate
CID 113066591
N-benzyl-N-(2-hydroxyethyl)-2-methylsulfonylpropanamide
CID 115582885
N-benzyl-N-[2-(4-methylpiperazin-1-yl)ethyl]methanesulfonamide
CID 110670077
N-benzyl-1-(2,4-difluorophenyl)-N-(2-hydroxyethyl)methanesulfonamide
CID 110018858
N-benzyl-N-[(4-phenoxyphenyl)methyl]methanesulfonamide
CID 57267401

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(2-hydroxyethyl)methanesulfonamide?
The IUPAC name of N-benzyl-N-(2-hydroxyethyl)methanesulfonamide (CID 3329134) is N-benzyl-N-(2-hydroxyethyl)methanesulfonamide.
What is the SMILES notation for N-benzyl-N-(2-hydroxyethyl)methanesulfonamide?
The canonical SMILES for N-benzyl-N-(2-hydroxyethyl)methanesulfonamide is CS(=O)(=O)N(CCO)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-(2-hydroxyethyl)methanesulfonamide?
The InChIKey is JIKFKPWBLFMOPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3S/c1-15(13,14)11(7-8-12)9-10-5-3-2-4-6-10/h2-6,12H,7-9H2,1H3.
What are the key properties of N-benzyl-N-(2-hydroxyethyl)methanesulfonamide?
N-benzyl-N-(2-hydroxyethyl)methanesulfonamide has a molecular weight of 229.30 g/mol, XLogP of 0.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(2-hydroxyethyl)methanesulfonamide is sourced from PubChem (CID 3329134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).