N-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide

C15H17NO5S — CID 166288259

IUPACN-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide
SMILESCOc1ccc(O)cc1-c1ccc(S(=O)(=O)NCCO)cc1
InChIInChI=1S/C15H17NO5S/c1-21-15-7-4-12(18)10-14(15)11-2-5-13(6-3-11)22(19,20)16-8-9-17/h2-7,10,16-18H,8-9H2,1H3
InChIKeyHSMFDONAYHHHBO-UHFFFAOYSA-N
MW323.37 g/mol
LogP1.34
Rot. Bonds6

About N-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide

N-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide (PubChem CID 166288259) has the molecular formula C15H17NO5S and a molecular weight of 323.37 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide
PubChem CID166288259
Molecular FormulaC15H17NO5S
Molecular Weight323.37 g/mol
Exact Mass323.08
IUPAC NameN-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide
SMILESCOc1ccc(O)cc1-c1ccc(S(=O)(=O)NCCO)cc1
InChIInChI=1S/C15H17NO5S/c1-21-15-7-4-12(18)10-14(15)11-2-5-13(6-3-11)22(19,20)16-8-9-17/h2-7,10,16-18H,8-9H2,1H3
InChIKeyHSMFDONAYHHHBO-UHFFFAOYSA-N
XLogP1.34
TPSA95.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.37
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-hydroxyethyl)-4-methoxybenzenesulfonamide
CID 2055080
3-bromo-N-(6-hydroxyhexyl)-4-methoxybenzenesulfonamide
CID 103918422
3-amino-N-(6-hydroxyhexyl)-4-methoxybenzenesulfonamide
CID 107843502
N-(2-hydroxyethyl)-3-methoxybenzenesulfonamide
CID 81258228
4-chloro-N-(2-hydroxyethyl)-2-methoxybenzenesulfonamide
CID 43501996
3-chloro-N-[2-(2-hydroxyethoxy)ethyl]-4-methoxybenzenesulfonamide
CID 62498134
5-(4-hydroxybutylsulfamoyl)-2-methoxybenzoic acid
CID 106840452
N-[2-(2-methoxy-4-methylphenoxy)ethyl]-4-methylbenzenesulfonamide
CID 113101853
N-ethyl-3-hydroxy-4-methoxybenzenesulfonamide
CID 165487001
3-(5-hydroxy-3-pyridinyl)-4-methoxy-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 170510592
4-methoxy-3-[4-(methoxymethyl)phenyl]-N-[(3-methyloxetan-3-yl)methyl]benzenesulfonamide
CID 171909560
3-fluoro-N-[3-(2-hydroxyethoxy)propyl]-4-methoxybenzenesulfonamide
CID 104600565

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide?
The IUPAC name of N-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide (CID 166288259) is N-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide.
What is the SMILES notation for N-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide?
The canonical SMILES for N-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide is COc1ccc(O)cc1-c1ccc(S(=O)(=O)NCCO)cc1.
What is the InChIKey of N-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide?
The InChIKey is HSMFDONAYHHHBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO5S/c1-21-15-7-4-12(18)10-14(15)11-2-5-13(6-3-11)22(19,20)16-8-9-17/h2-7,10,16-18H,8-9H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide?
N-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide has a molecular weight of 323.37 g/mol, XLogP of 1.34, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-4-(5-hydroxy-2-methoxyphenyl)benzenesulfonamide is sourced from PubChem (CID 166288259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).