4-(5-hydroxypentylsulfamoyl)benzamide

C12H18N2O4S — CID 107319438

IUPAC4-(5-hydroxypentylsulfamoyl)benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)NCCCCCO)cc1
InChIInChI=1S/C12H18N2O4S/c13-12(16)10-4-6-11(7-5-10)19(17,18)14-8-2-1-3-9-15/h4-7,14-15H,1-3,8-9H2,(H2,13,16)
InChIKeyAUNCIUVUTCGXDM-UHFFFAOYSA-N
MW286.35 g/mol
LogP0.23
Rot. Bonds8

About 4-(5-hydroxypentylsulfamoyl)benzamide

4-(5-hydroxypentylsulfamoyl)benzamide (PubChem CID 107319438) has the molecular formula C12H18N2O4S and a molecular weight of 286.35 g/mol. Its IUPAC name is 4-(5-hydroxypentylsulfamoyl)benzamide.

Molecular Properties

Compound Name4-(5-hydroxypentylsulfamoyl)benzamide
PubChem CID107319438
Molecular FormulaC12H18N2O4S
Molecular Weight286.35 g/mol
Exact Mass286.10
IUPAC Name4-(5-hydroxypentylsulfamoyl)benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)NCCCCCO)cc1
InChIInChI=1S/C12H18N2O4S/c13-12(16)10-4-6-11(7-5-10)19(17,18)14-8-2-1-3-9-15/h4-7,14-15H,1-3,8-9H2,(H2,13,16)
InChIKeyAUNCIUVUTCGXDM-UHFFFAOYSA-N
XLogP0.23
TPSA109.49 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 50.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-[(4-carbamoylphenyl)sulfonylamino]hexanoic acid
CID 43241522
4-amino-N-(5-hydroxypentyl)benzenesulfonamide
CID 107316374
methyl 4-(4-hydroxybutylsulfamoyl)benzoate
CID 106844012
5-[[4-(4-carbamoylphenoxy)phenyl]sulfonylamino]pentanoic acid
CID 171726310
4-(2-hydroxyethylsulfamoyl)benzoic acid
CID 15944537
5-[(4-carbamothioylphenyl)sulfonylamino]pentanamide
CID 106237168
4-[7-[(4-carbamimidoylphenyl)sulfonylamino]heptylsulfamoyl]benzenecarboximidamide;dihydrochloride
CID 162333556
4-(aminomethyl)-N-(3-hydroxypropyl)benzenesulfonamide
CID 102537257
(E)-4-[4-(3-hydroxypropylsulfamoyl)phenyl]-4-oxobut-2-enoic acid
CID 94780188
N-(5-hydroxypentyl)-4-(4-isocyanophenyl)benzenesulfonamide
CID 59728337
N-(5-aminopentyl)-4-(2,2-dimethylpropanoyl)benzenesulfonamide
CID 20604027
4-chloro-N-(3-hydroxypropyl)benzenesulfonamide
CID 5127490

Frequently Asked Questions

What is the IUPAC name of 4-(5-hydroxypentylsulfamoyl)benzamide?
The IUPAC name of 4-(5-hydroxypentylsulfamoyl)benzamide (CID 107319438) is 4-(5-hydroxypentylsulfamoyl)benzamide.
What is the SMILES notation for 4-(5-hydroxypentylsulfamoyl)benzamide?
The canonical SMILES for 4-(5-hydroxypentylsulfamoyl)benzamide is NC(=O)c1ccc(S(=O)(=O)NCCCCCO)cc1.
What is the InChIKey of 4-(5-hydroxypentylsulfamoyl)benzamide?
The InChIKey is AUNCIUVUTCGXDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O4S/c13-12(16)10-4-6-11(7-5-10)19(17,18)14-8-2-1-3-9-15/h4-7,14-15H,1-3,8-9H2,(H2,13,16).
What are the key properties of 4-(5-hydroxypentylsulfamoyl)benzamide?
4-(5-hydroxypentylsulfamoyl)benzamide has a molecular weight of 286.35 g/mol, XLogP of 0.23, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-hydroxypentylsulfamoyl)benzamide is sourced from PubChem (CID 107319438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).