N-[5-(2-amino-1-hydroxyethyl)-2-hydroxyphenyl]methanesulphonamide

HCID 9837752
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Basic information

CAS
13698-56-1
Standard SMILES
CS(=O)(=O)Nc1cc(C(O)CN)ccc1O
InChIKey
PBLGWDFXCCRJAV-UHFFFAOYSA-N
Molecular formula
C9H14N2O4S
Average molar mass
246.29 g/mol
Monoisotopic mass
246.06742793

Names & identifiers

Preferred name
N-[5-(2-amino-1-hydroxyethyl)-2-hydroxyphenyl]methanesulphonamide
IUPAC
N-[5-(2-amino-1-hydroxyethyl)-2-hydroxyphenyl]methanesulfonamide

Names & synonyms

CHEMBL31963213698-56-1N-[5-(2-Amino-1-hydroxy-ethyl)-2-hydroxy-phenyl]-methanesulfonamideN-[5-(2-amino-1-hydroxyethyl)-2-hydroxyphenyl]methanesulphonamideN-[5-(2-AMINO-1-HYDROXYETHYL)-2-HYDROXYPHENYL]METHANESULFONAMIDESCHEMBL5943668DTXSID20431610PBLGWDFXCCRJAV-UHFFFAOYSA-NBDBM50106803N-[5-(2-Amino-1-hydroxy-ethyl)-2-hydroxy-phenyl]-methanesulfonamidN-[5-(2-Amino-1-hydroxy-ethyl)-2-hydroxyphenyl]-methanesulfonamidN-[5-(2-Amino-1-hydroxy-ethyl)-2-hydroxyphenyl]-methanesulfonamide
Show more names
N-[5-(2-amino-1hydroxy-ethyl)-2-hydroxy-phenyl]-methanesulfonamideN-[5-(-2-amino-1-hydroxy-ethyl)-2-hydroxy-phenyl]-methanesulfonamide

Database identifiers

CAS
13698-56-1
PubChem CID
9837752
DTXSID
DTXSID20431610
ChEMBL
CHEMBL319632
Nikkaji
J1.642.008E

Properties

Computed structural properties

XLogP
-1.9
Topological polar surface area
121 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
16

Related reactions

102 records
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Compound notes

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