N-(butanoylsulfamoyl)butanamide

C8H16N2O4S — CID 57312310

IUPACN-(butanoylsulfamoyl)butanamide
SMILESCCCC(=O)NS(=O)(=O)NC(=O)CCC
InChIInChI=1S/C8H16N2O4S/c1-3-5-7(11)9-15(13,14)10-8(12)6-4-2/h3-6H2,1-2H3,(H,9,11)(H,10,12)
InChIKeyPONGRLCOOUAJME-UHFFFAOYSA-N
MW236.29 g/mol
LogP0.06
Rot. Bonds6

About N-(butanoylsulfamoyl)butanamide

N-(butanoylsulfamoyl)butanamide (PubChem CID 57312310) has the molecular formula C8H16N2O4S and a molecular weight of 236.29 g/mol. Its IUPAC name is N-(butanoylsulfamoyl)butanamide.

Molecular Properties

Compound NameN-(butanoylsulfamoyl)butanamide
PubChem CID57312310
Molecular FormulaC8H16N2O4S
Molecular Weight236.29 g/mol
Exact Mass236.08
IUPAC NameN-(butanoylsulfamoyl)butanamide
SMILESCCCC(=O)NS(=O)(=O)NC(=O)CCC
InChIInChI=1S/C8H16N2O4S/c1-3-5-7(11)9-15(13,14)10-8(12)6-4-2/h3-6H2,1-2H3,(H,9,11)(H,10,12)
InChIKeyPONGRLCOOUAJME-UHFFFAOYSA-N
XLogP0.06
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.29
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(butanoylsulfamoyl)butanamide?
The IUPAC name of N-(butanoylsulfamoyl)butanamide (CID 57312310) is N-(butanoylsulfamoyl)butanamide.
What is the SMILES notation for N-(butanoylsulfamoyl)butanamide?
The canonical SMILES for N-(butanoylsulfamoyl)butanamide is CCCC(=O)NS(=O)(=O)NC(=O)CCC.
What is the InChIKey of N-(butanoylsulfamoyl)butanamide?
The InChIKey is PONGRLCOOUAJME-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O4S/c1-3-5-7(11)9-15(13,14)10-8(12)6-4-2/h3-6H2,1-2H3,(H,9,11)(H,10,12).
What are the key properties of N-(butanoylsulfamoyl)butanamide?
N-(butanoylsulfamoyl)butanamide has a molecular weight of 236.29 g/mol, XLogP of 0.06, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(butanoylsulfamoyl)butanamide is sourced from PubChem (CID 57312310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).