1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene

C10H16N2O3S — CID 61017659

IUPAC1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene
SMILESCN(C)S(=O)(=O)NCCc1ccc(O)cc1
InChIInChI=1S/C10H16N2O3S/c1-12(2)16(14,15)11-8-7-9-3-5-10(13)6-4-9/h3-6,11,13H,7-8H2,1-2H3
InChIKeyXUMUSZHQSBWOGF-UHFFFAOYSA-N
MW244.32 g/mol
LogP0.33
Rot. Bonds5

About 1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene

1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene (PubChem CID 61017659) has the molecular formula C10H16N2O3S and a molecular weight of 244.32 g/mol. Its IUPAC name is 1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene.

Molecular Properties

Compound Name1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene
PubChem CID61017659
Molecular FormulaC10H16N2O3S
Molecular Weight244.32 g/mol
Exact Mass244.09
IUPAC Name1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene
SMILESCN(C)S(=O)(=O)NCCc1ccc(O)cc1
InChIInChI=1S/C10H16N2O3S/c1-12(2)16(14,15)11-8-7-9-3-5-10(13)6-4-9/h3-6,11,13H,7-8H2,1-2H3
InChIKeyXUMUSZHQSBWOGF-UHFFFAOYSA-N
XLogP0.33
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-hydroxy-4-[2-[[methyl(propan-2-yl)sulfamoyl]amino]ethyl]benzene
CID 54947518
1-[2-(diethylsulfamoylamino)ethyl]-4-hydroxybenzene
CID 54904084
1-[(dimethylsulfamoylamino)methyl]-4-hydroxybenzene
CID 115753679
1-[2-(dimethylsulfamoylamino)ethyl]-4-(trifluoromethyl)benzene
CID 35302797
1-[2-(dimethylsulfamoylamino)ethyl]-4-propan-2-ylsulfonylbenzene
CID 110790785
N-[2-(4-hydroxyphenyl)ethyl]-4-methylbenzenesulfonamide
CID 10424386
1-[3-(dimethylsulfamoylamino)propyl]-3-hydroxybenzene
CID 110667288
methyl N-[2-(4-hydroxyphenyl)ethylsulfamoyl]carbamate
CID 114463964
2-(dimethylsulfamoylamino)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 112993422
1-[4-(dimethylsulfamoylamino)butyl]-4-methoxybenzene
CID 110288832
2-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]benzenesulfonamide
CID 81241265
5-[2-(dimethylsulfamoylamino)ethyl]-2,3-dihydro-1-benzofuran
CID 110792417

Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene?
The IUPAC name of 1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene (CID 61017659) is 1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene.
What is the SMILES notation for 1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene?
The canonical SMILES for 1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene is CN(C)S(=O)(=O)NCCc1ccc(O)cc1.
What is the InChIKey of 1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene?
The InChIKey is XUMUSZHQSBWOGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3S/c1-12(2)16(14,15)11-8-7-9-3-5-10(13)6-4-9/h3-6,11,13H,7-8H2,1-2H3.
What are the key properties of 1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene?
1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene has a molecular weight of 244.32 g/mol, XLogP of 0.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylsulfamoylamino)ethyl]-4-hydroxybenzene is sourced from PubChem (CID 61017659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).