4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide

C11H16ClNO4S — CID 54879156

IUPAC4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide
SMILESCCN(CCO)S(=O)(=O)c1ccc(Cl)cc1OC
InChIInChI=1S/C11H16ClNO4S/c1-3-13(6-7-14)18(15,16)11-5-4-9(12)8-10(11)17-2/h4-5,8,14H,3,6-7H2,1-2H3
InChIKeyGCNHMBYPCCQOTR-UHFFFAOYSA-N
MW293.77 g/mol
LogP1.35
Rot. Bonds6

About 4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide

4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide (PubChem CID 54879156) has the molecular formula C11H16ClNO4S and a molecular weight of 293.77 g/mol. Its IUPAC name is 4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide.

Molecular Properties

Compound Name4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide
PubChem CID54879156
Molecular FormulaC11H16ClNO4S
Molecular Weight293.77 g/mol
Exact Mass293.05
IUPAC Name4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide
SMILESCCN(CCO)S(=O)(=O)c1ccc(Cl)cc1OC
InChIInChI=1S/C11H16ClNO4S/c1-3-13(6-7-14)18(15,16)11-5-4-9(12)8-10(11)17-2/h4-5,8,14H,3,6-7H2,1-2H3
InChIKeyGCNHMBYPCCQOTR-UHFFFAOYSA-N
XLogP1.35
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.77
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N,N-bis(2-hydroxyethyl)-2-methoxybenzenesulfonamide
CID 61233833
2-[(4-chloro-2-methoxyphenyl)sulfonyl-propylamino]acetic acid
CID 61007535
5-chloro-2-cyano-N-ethyl-N-(2-hydroxyethyl)benzenesulfonamide
CID 54879174
4-chloro-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide
CID 43501996
methyl 2-[(4-chloro-2-methoxyphenyl)sulfonyl-methylamino]acetate
CID 43422565
4-amino-N-ethyl-2-methoxy-N-(2-methoxyethyl)benzenesulfonamide
CID 61444696
2-fluoro-N,N-bis(2-hydroxyethyl)-4,5-dimethoxybenzenesulfonamide
CID 61234361
4-chloro-N-(3-hydroxypropyl)-2-methoxybenzenesulfonamide
CID 43501480
4-chloro-N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-2-fluorobenzenesulfonamide
CID 8801326
N-(3-amino-4-methylpentyl)-4-chloro-2-methoxy-N-methylbenzenesulfonamide
CID 115317679
4-chloro-2-methoxybenzenesulfonyl chloride
CID 15725376
2-chloro-N-ethyl-N-(2-hydroxyethyl)benzenesulfonamide
CID 60957799

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide?
The IUPAC name of 4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide (CID 54879156) is 4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide.
What is the SMILES notation for 4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide?
The canonical SMILES for 4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide is CCN(CCO)S(=O)(=O)c1ccc(Cl)cc1OC.
What is the InChIKey of 4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide?
The InChIKey is GCNHMBYPCCQOTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClNO4S/c1-3-13(6-7-14)18(15,16)11-5-4-9(12)8-10(11)17-2/h4-5,8,14H,3,6-7H2,1-2H3.
What are the key properties of 4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide?
4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide has a molecular weight of 293.77 g/mol, XLogP of 1.35, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide is sourced from PubChem (CID 54879156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).