2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide

C12H18N2O4S — CID 81245074

IUPAC2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide
SMILESCN1CCOC(CNS(=O)(=O)c2ccccc2O)C1
InChIInChI=1S/C12H18N2O4S/c1-14-6-7-18-10(9-14)8-13-19(16,17)12-5-3-2-4-11(12)15/h2-5,10,13,15H,6-9H2,1H3
InChIKeyUNXQZFKZJXKNOG-UHFFFAOYSA-N
MW286.35 g/mol
LogP0.00
Rot. Bonds4

About 2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide

2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide (PubChem CID 81245074) has the molecular formula C12H18N2O4S and a molecular weight of 286.35 g/mol. Its IUPAC name is 2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide.

Molecular Properties

Compound Name2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide
PubChem CID81245074
Molecular FormulaC12H18N2O4S
Molecular Weight286.35 g/mol
Exact Mass286.10
IUPAC Name2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide
SMILESCN1CCOC(CNS(=O)(=O)c2ccccc2O)C1
InChIInChI=1S/C12H18N2O4S/c1-14-6-7-18-10(9-14)8-13-19(16,17)12-5-3-2-4-11(12)15/h2-5,10,13,15H,6-9H2,1H3
InChIKeyUNXQZFKZJXKNOG-UHFFFAOYSA-N
XLogP0.00
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 50.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(aminomethyl)-3-fluoro-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide
CID 79078860
5-bromo-4-[(4-methylmorpholin-2-yl)methylsulfamoyl]furan-2-carboxylic acid
CID 79079920
4-(aminomethyl)-2-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide
CID 106997035
4-bromo-2-fluoro-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide
CID 116528706
2-amino-4-chloro-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide
CID 79083271
N-[(4-methylmorpholin-2-yl)methyl]-1-(2-methylphenyl)methanesulfonamide
CID 110710274
N-[(4-methylmorpholin-2-yl)methyl]-2-phenylethanesulfonamide
CID 110710282
5-amino-4-bromo-2-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide
CID 114625895
1-[2-(aminomethyl)phenyl]-N-[(4-methylmorpholin-2-yl)methyl]methanesulfonamide
CID 79079333
5-amino-2,3-difluoro-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide
CID 79080372
3-[(4-methylmorpholin-2-yl)methylsulfamoyl]benzenecarbothioamide
CID 79083016
3-amino-2,6-dimethyl-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide
CID 79079568

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide?
The IUPAC name of 2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide (CID 81245074) is 2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide.
What is the SMILES notation for 2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide?
The canonical SMILES for 2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide is CN1CCOC(CNS(=O)(=O)c2ccccc2O)C1.
What is the InChIKey of 2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide?
The InChIKey is UNXQZFKZJXKNOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O4S/c1-14-6-7-18-10(9-14)8-13-19(16,17)12-5-3-2-4-11(12)15/h2-5,10,13,15H,6-9H2,1H3.
What are the key properties of 2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide?
2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide has a molecular weight of 286.35 g/mol, XLogP of 0.00, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide is sourced from PubChem (CID 81245074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).