2-[2-(methylsulfamoylamino)ethyl]phenol

C9H14N2O3S — CID 110614890

IUPAC2-[2-(methylsulfamoylamino)ethyl]phenol
SMILESCNS(=O)(=O)NCCc1ccccc1O
InChIInChI=1S/C9H14N2O3S/c1-10-15(13,14)11-7-6-8-4-2-3-5-9(8)12/h2-5,10-12H,6-7H2,1H3
InChIKeyIEJKERZWJWNQOV-UHFFFAOYSA-N
MW230.29 g/mol
LogP-0.01
Rot. Bonds5

About 2-[2-(methylsulfamoylamino)ethyl]phenol

2-[2-(methylsulfamoylamino)ethyl]phenol (PubChem CID 110614890) has the molecular formula C9H14N2O3S and a molecular weight of 230.29 g/mol. Its IUPAC name is 2-[2-(methylsulfamoylamino)ethyl]phenol.

Molecular Properties

Compound Name2-[2-(methylsulfamoylamino)ethyl]phenol
PubChem CID110614890
Molecular FormulaC9H14N2O3S
Molecular Weight230.29 g/mol
Exact Mass230.07
IUPAC Name2-[2-(methylsulfamoylamino)ethyl]phenol
SMILESCNS(=O)(=O)NCCc1ccccc1O
InChIInChI=1S/C9H14N2O3S/c1-10-15(13,14)11-7-6-8-4-2-3-5-9(8)12/h2-5,10-12H,6-7H2,1H3
InChIKeyIEJKERZWJWNQOV-UHFFFAOYSA-N
XLogP-0.01
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 5-0.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-N-[2-(2-hydroxyphenyl)ethyl]benzenesulfonamide
CID 110605294
N-[2-(2-hydroxyphenyl)ethyl]thiophene-2-sulfonamide
CID 110605316
3-chloro-N-[2-(2-hydroxyphenyl)ethyl]benzenesulfonamide
CID 110605350
2-[2-(ethylamino)ethyl]phenol;hydrochloride
CID 68825944
N-[2-(2-hydroxyphenyl)ethyl]-4-methoxy-2-methylbenzenesulfonamide
CID 110605307
2-ethylphenol;N-methylmethanamine
CID 118325670
(2R)-2-amino-N-[2-(2-hydroxyphenyl)ethyl]propanamide
CID 120872754
CID 175749710
CID 175749710
N-[2-(2-hydroxyphenyl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 110605313
2-[(2-hydroxyphenyl)methylsulfamoyl]propanoic acid
CID 114331355
N-[2-(2-bromophenyl)ethyl]propane-2-sulfonamide
CID 48945854
N-[2-(2-hydroxyphenyl)ethyl]-2-sulfanylacetamide
CID 141064188

Frequently Asked Questions

What is the IUPAC name of 2-[2-(methylsulfamoylamino)ethyl]phenol?
The IUPAC name of 2-[2-(methylsulfamoylamino)ethyl]phenol (CID 110614890) is 2-[2-(methylsulfamoylamino)ethyl]phenol.
What is the SMILES notation for 2-[2-(methylsulfamoylamino)ethyl]phenol?
The canonical SMILES for 2-[2-(methylsulfamoylamino)ethyl]phenol is CNS(=O)(=O)NCCc1ccccc1O.
What is the InChIKey of 2-[2-(methylsulfamoylamino)ethyl]phenol?
The InChIKey is IEJKERZWJWNQOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O3S/c1-10-15(13,14)11-7-6-8-4-2-3-5-9(8)12/h2-5,10-12H,6-7H2,1H3.
What are the key properties of 2-[2-(methylsulfamoylamino)ethyl]phenol?
2-[2-(methylsulfamoylamino)ethyl]phenol has a molecular weight of 230.29 g/mol, XLogP of -0.01, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methylsulfamoylamino)ethyl]phenol is sourced from PubChem (CID 110614890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).