4-(propylsulfamoylamino)benzenesulfonamide

C9H15N3O4S2 — CID 114812408

IUPAC4-(propylsulfamoylamino)benzenesulfonamide
SMILESCCCNS(=O)(=O)Nc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C9H15N3O4S2/c1-2-7-11-18(15,16)12-8-3-5-9(6-4-8)17(10,13)14/h3-6,11-12H,2,7H2,1H3,(H2,10,13,14)
InChIKeyLEJSTAQDCIYMAX-UHFFFAOYSA-N
MW293.37 g/mol
LogP-0.01
Rot. Bonds6

About 4-(propylsulfamoylamino)benzenesulfonamide

4-(propylsulfamoylamino)benzenesulfonamide (PubChem CID 114812408) has the molecular formula C9H15N3O4S2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 4-(propylsulfamoylamino)benzenesulfonamide.

Molecular Properties

Compound Name4-(propylsulfamoylamino)benzenesulfonamide
PubChem CID114812408
Molecular FormulaC9H15N3O4S2
Molecular Weight293.37 g/mol
Exact Mass293.05
IUPAC Name4-(propylsulfamoylamino)benzenesulfonamide
SMILESCCCNS(=O)(=O)Nc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C9H15N3O4S2/c1-2-7-11-18(15,16)12-8-3-5-9(6-4-8)17(10,13)14/h3-6,11-12H,2,7H2,1H3,(H2,10,13,14)
InChIKeyLEJSTAQDCIYMAX-UHFFFAOYSA-N
XLogP-0.01
TPSA118.36 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 5-0.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-1-N-(propylsulfamoyl)benzene-1,3-diamine
CID 114804266
4-phenoxy-N-(propylsulfamoyl)aniline
CID 110425619
4-(methanesulfonamido)-N-propylbenzenesulfonamide
CID 6458395
3-(ethylsulfamoylamino)benzenesulfonamide
CID 114812411
4-(2-hydroxyethylsulfonylamino)benzenesulfonamide
CID 79026491
4-[(2S)-butan-2-yl]-N-(4-sulfamoylphenyl)benzenesulfonamide
CID 2524649
5-fluoro-3-N-(propylsulfamoyl)benzene-1,3-diamine
CID 107334287
4-(pentan-2-ylamino)benzenesulfonamide
CID 43193552
4-naphthalen-1-yloxy-N-(propylsulfamoyl)aniline
CID 59962132
N-[4-[[4-(propylsulfamoyl)phenyl]sulfamoyl]phenyl]acetamide
CID 2134216
3-bromo-5-methyl-N-(propylsulfamoyl)aniline
CID 110614185
N-[4-(2-aminoethylsulfamoylamino)phenyl]acetamide
CID 84761036

Frequently Asked Questions

What is the IUPAC name of 4-(propylsulfamoylamino)benzenesulfonamide?
The IUPAC name of 4-(propylsulfamoylamino)benzenesulfonamide (CID 114812408) is 4-(propylsulfamoylamino)benzenesulfonamide.
What is the SMILES notation for 4-(propylsulfamoylamino)benzenesulfonamide?
The canonical SMILES for 4-(propylsulfamoylamino)benzenesulfonamide is CCCNS(=O)(=O)Nc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 4-(propylsulfamoylamino)benzenesulfonamide?
The InChIKey is LEJSTAQDCIYMAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O4S2/c1-2-7-11-18(15,16)12-8-3-5-9(6-4-8)17(10,13)14/h3-6,11-12H,2,7H2,1H3,(H2,10,13,14).
What are the key properties of 4-(propylsulfamoylamino)benzenesulfonamide?
4-(propylsulfamoylamino)benzenesulfonamide has a molecular weight of 293.37 g/mol, XLogP of -0.01, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(propylsulfamoylamino)benzenesulfonamide is sourced from PubChem (CID 114812408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).