2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide

C11H15ClN2O4S — CID 106339733

IUPAC2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide
SMILESCN(C)S(=O)(=O)CCNC(=O)c1cc(O)ccc1Cl
InChIInChI=1S/C11H15ClN2O4S/c1-14(2)19(17,18)6-5-13-11(16)9-7-8(15)3-4-10(9)12/h3-4,7,15H,5-6H2,1-2H3,(H,13,16)
InChIKeyAHZRSPNQPDRYLH-UHFFFAOYSA-N
MW306.77 g/mol
LogP0.67
Rot. Bonds5

About 2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide

2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide (PubChem CID 106339733) has the molecular formula C11H15ClN2O4S and a molecular weight of 306.77 g/mol. Its IUPAC name is 2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide.

Molecular Properties

Compound Name2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide
PubChem CID106339733
Molecular FormulaC11H15ClN2O4S
Molecular Weight306.77 g/mol
Exact Mass306.04
IUPAC Name2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide
SMILESCN(C)S(=O)(=O)CCNC(=O)c1cc(O)ccc1Cl
InChIInChI=1S/C11H15ClN2O4S/c1-14(2)19(17,18)6-5-13-11(16)9-7-8(15)3-4-10(9)12/h3-4,7,15H,5-6H2,1-2H3,(H,13,16)
InChIKeyAHZRSPNQPDRYLH-UHFFFAOYSA-N
XLogP0.67
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.77
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-(2-ethylsulfonylethyl)-5-hydroxybenzamide
CID 106741452
4-chloro-N-[2-(dimethylsulfamoyl)ethyl]-2-hydroxybenzamide
CID 106339696
2-chloro-5-hydroxy-N-(3-sulfamoylpropyl)benzamide
CID 106501692
N-[2-(dimethylsulfamoyl)ethyl]-2,3-dihydroxybenzamide
CID 106339701
2-chloro-5-hydroxy-N-[2-(propan-2-ylamino)ethyl]benzamide
CID 106502576
4-bromo-3-chloro-N-[2-(dimethylsulfamoyl)ethyl]benzamide
CID 114175557
4-amino-3-chloro-N-[2-(dimethylsulfamoyl)ethyl]benzamide
CID 106333004
methyl 3-[(2-chloro-5-hydroxybenzoyl)amino]propanoate
CID 106501475
N-[2-(dimethylsulfamoyl)ethyl]-2-sulfanylbenzamide
CID 106340126
5-amino-2-bromo-N-[2-(dimethylsulfamoyl)ethyl]benzamide
CID 106333048
2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide
CID 106502069
2,5-dibromo-N-[2-(dimethylsulfamoyl)ethyl]thiophene-3-carboxamide
CID 106339469

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide?
The IUPAC name of 2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide (CID 106339733) is 2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide.
What is the SMILES notation for 2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide?
The canonical SMILES for 2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide is CN(C)S(=O)(=O)CCNC(=O)c1cc(O)ccc1Cl.
What is the InChIKey of 2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide?
The InChIKey is AHZRSPNQPDRYLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O4S/c1-14(2)19(17,18)6-5-13-11(16)9-7-8(15)3-4-10(9)12/h3-4,7,15H,5-6H2,1-2H3,(H,13,16).
What are the key properties of 2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide?
2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide has a molecular weight of 306.77 g/mol, XLogP of 0.67, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide is sourced from PubChem (CID 106339733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).