4-(cyclopentylsulfamoyl)butanoic acid

C9H17NO4S — CID 28513439

IUPAC4-(cyclopentylsulfamoyl)butanoic acid
SMILESO=C(O)CCCS(=O)(=O)NC1CCCC1
InChIInChI=1S/C9H17NO4S/c11-9(12)6-3-7-15(13,14)10-8-4-1-2-5-8/h8,10H,1-7H2,(H,11,12)
InChIKeyPCCWPCSGCDNAND-UHFFFAOYSA-N
MW235.30 g/mol
LogP0.71
Rot. Bonds6

About 4-(cyclopentylsulfamoyl)butanoic acid

4-(cyclopentylsulfamoyl)butanoic acid (PubChem CID 28513439) has the molecular formula C9H17NO4S and a molecular weight of 235.30 g/mol. Its IUPAC name is 4-(cyclopentylsulfamoyl)butanoic acid.

Molecular Properties

Compound Name4-(cyclopentylsulfamoyl)butanoic acid
PubChem CID28513439
Molecular FormulaC9H17NO4S
Molecular Weight235.30 g/mol
Exact Mass235.09
IUPAC Name4-(cyclopentylsulfamoyl)butanoic acid
SMILESO=C(O)CCCS(=O)(=O)NC1CCCC1
InChIInChI=1S/C9H17NO4S/c11-9(12)6-3-7-15(13,14)10-8-4-1-2-5-8/h8,10H,1-7H2,(H,11,12)
InChIKeyPCCWPCSGCDNAND-UHFFFAOYSA-N
XLogP0.71
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5,5,5-Trifluoropentylsulfamoyl)butanoic acid
CID 115515935
2-(Butylsulfonylamino)butanoic acid
CID 24262892
2-(Cyclopentylsulfamoyl)-2-methylpropanoic acid
CID 59634184
4-(Cyclobutylsulfamoyl)butanoic acid
CID 62416914
(2S)-2-amino-4-(cyclohexylsulfamoyl)butanoic acid
CID 67154280
(2R)-2-amino-3-(cyclopentylsulfamoyl)propanoic acid
CID 67154972
2-Amino-3-(cyclopentylsulfamoyl)propanoic acid
CID 70945571
2-Amino-4-(cyclohexylsulfamoyl)butanoic acid
CID 70945693
(2S)-2-amino-4-(cyclopentylsulfonylamino)butanoic acid
CID 70945838
2-Amino-4-(cyclopentylsulfonylamino)butanoic acid
CID 70945841
(2S)-2-amino-4-(cyclopentylsulfamoyl)butanoic acid
CID 70945947
2-Amino-4-(cyclopentylsulfamoyl)butanoic acid
CID 70945948

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopentylsulfamoyl)butanoic acid?
The IUPAC name of 4-(cyclopentylsulfamoyl)butanoic acid (CID 28513439) is 4-(cyclopentylsulfamoyl)butanoic acid.
What is the SMILES notation for 4-(cyclopentylsulfamoyl)butanoic acid?
The canonical SMILES for 4-(cyclopentylsulfamoyl)butanoic acid is O=C(O)CCCS(=O)(=O)NC1CCCC1.
What is the InChIKey of 4-(cyclopentylsulfamoyl)butanoic acid?
The InChIKey is PCCWPCSGCDNAND-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO4S/c11-9(12)6-3-7-15(13,14)10-8-4-1-2-5-8/h8,10H,1-7H2,(H,11,12).
What are the key properties of 4-(cyclopentylsulfamoyl)butanoic acid?
4-(cyclopentylsulfamoyl)butanoic acid has a molecular weight of 235.30 g/mol, XLogP of 0.71, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopentylsulfamoyl)butanoic acid is sourced from PubChem (CID 28513439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).