2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide

C10H15NO3S — CID 14006033

IUPAC2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide
SMILESCC(O)c1ccccc1S(=O)(=O)N(C)C
InChIInChI=1S/C10H15NO3S/c1-8(12)9-6-4-5-7-10(9)15(13,14)11(2)3/h4-8,12H,1-3H3
InChIKeyQMXDSQWIVWMDQO-UHFFFAOYSA-N
MW229.30 g/mol
LogP0.99
Rot. Bonds3

About 2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide

2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide (PubChem CID 14006033) has the molecular formula C10H15NO3S and a molecular weight of 229.30 g/mol. Its IUPAC name is 2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide.

Molecular Properties

Compound Name2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide
PubChem CID14006033
Molecular FormulaC10H15NO3S
Molecular Weight229.30 g/mol
Exact Mass229.08
IUPAC Name2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide
SMILESCC(O)c1ccccc1S(=O)(=O)N(C)C
InChIInChI=1S/C10H15NO3S/c1-8(12)9-6-4-5-7-10(9)15(13,14)11(2)3/h4-8,12H,1-3H3
InChIKeyQMXDSQWIVWMDQO-UHFFFAOYSA-N
XLogP0.99
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(dicyanomethyl)-N,N-dimethylbenzenesulfonamide
CID 112737339
2-(2-aminoacetyl)-N,N-dimethylbenzenesulfonamide
CID 170861049
2-[2-(dimethylsulfamoyl)-N-propan-2-ylanilino]acetic acid
CID 60829714
2-(3-hydroxy-2-methylpropyl)sulfanyl-N,N-dimethylbenzenesulfonamide
CID 66104210
N,N-dimethyl-2-phenylbenzenesulfonamide
CID 19014102
2-[1-bromopropan-2-yl(methyl)amino]-N,N-dimethylbenzenesulfonamide
CID 113426409
2-(but-3-yn-2-ylamino)-N,N-dimethylbenzenesulfonamide
CID 114417934
N,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide
CID 176628991
2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]-N,N-dimethylbenzenesulfonamide
CID 115966620
2-(3-aminobutylamino)-N,N-dimethylbenzenesulfonamide
CID 63251442
2-[N-butan-2-yl-2-(dimethylsulfamoyl)anilino]acetic acid
CID 60839864
2-bromo-N-[1-(2-bromophenyl)ethyl]-N-methylbenzenesulfonamide
CID 138999711

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide?
The IUPAC name of 2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide (CID 14006033) is 2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide.
What is the SMILES notation for 2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide?
The canonical SMILES for 2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide is CC(O)c1ccccc1S(=O)(=O)N(C)C.
What is the InChIKey of 2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide?
The InChIKey is QMXDSQWIVWMDQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3S/c1-8(12)9-6-4-5-7-10(9)15(13,14)11(2)3/h4-8,12H,1-3H3.
What are the key properties of 2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide?
2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide has a molecular weight of 229.30 g/mol, XLogP of 0.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxyethyl)-N,N-dimethylbenzenesulfonamide is sourced from PubChem (CID 14006033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).