2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide

C11H13Cl2NO3S — CID 43577659

IUPAC2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide
SMILESO=S(=O)(c1cccc(Cl)c1Cl)N(CCO)C1CC1
InChIInChI=1S/C11H13Cl2NO3S/c12-9-2-1-3-10(11(9)13)18(16,17)14(6-7-15)8-4-5-8/h1-3,8,15H,4-7H2
InChIKeyNEYYQUPVGMDMGB-UHFFFAOYSA-N
MW310.20 g/mol
LogP2.14
Rot. Bonds5

About 2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide

2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide (PubChem CID 43577659) has the molecular formula C11H13Cl2NO3S and a molecular weight of 310.20 g/mol. Its IUPAC name is 2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide.

Molecular Properties

Compound Name2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide
PubChem CID43577659
Molecular FormulaC11H13Cl2NO3S
Molecular Weight310.20 g/mol
Exact Mass309.00
IUPAC Name2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide
SMILESO=S(=O)(c1cccc(Cl)c1Cl)N(CCO)C1CC1
InChIInChI=1S/C11H13Cl2NO3S/c12-9-2-1-3-10(11(9)13)18(16,17)14(6-7-15)8-4-5-8/h1-3,8,15H,4-7H2
InChIKeyNEYYQUPVGMDMGB-UHFFFAOYSA-N
XLogP2.14
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.20
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide
CID 43577489
2,4-dichloro-N-cyclopropyl-3-fluoro-N-(2-hydroxyethyl)benzenesulfonamide
CID 91662378
N-cyclopropyl-2-fluoro-N-(2-hydroxyethyl)benzenesulfonamide
CID 43577535
2-chloro-N-cyclobutyl-N-(3-hydroxypropyl)benzenesulfonamide
CID 102847463
2,3-dichloro-N-piperidin-4-yl-N-propylbenzenesulfonamide
CID 60806599
4-chloro-3-[cyclopropyl(2-hydroxyethyl)sulfamoyl]benzoic acid
CID 43578756
2-(aminomethyl)-N-cyclobutyl-3-fluoro-N-(2-hydroxyethyl)benzenesulfonamide
CID 102861412
N-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide
CID 43577670
2,5-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)thiophene-3-sulfonamide
CID 43577625
3-[cyclopropyl(2-hydroxyethyl)sulfamoyl]pyridine-2-carbothioamide
CID 106596981
2-chloro-N-cyclobutyl-N-(2-hydroxyethyl)-4-methylbenzenesulfonamide
CID 102675724
N-cyclopropyl-N-(2-hydroxyethyl)-2-methyl-3-nitrobenzenesulfonamide
CID 43577551

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide?
The IUPAC name of 2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide (CID 43577659) is 2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide.
What is the SMILES notation for 2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide?
The canonical SMILES for 2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide is O=S(=O)(c1cccc(Cl)c1Cl)N(CCO)C1CC1.
What is the InChIKey of 2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide?
The InChIKey is NEYYQUPVGMDMGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13Cl2NO3S/c12-9-2-1-3-10(11(9)13)18(16,17)14(6-7-15)8-4-5-8/h1-3,8,15H,4-7H2.
What are the key properties of 2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide?
2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide has a molecular weight of 310.20 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide is sourced from PubChem (CID 43577659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).