2-(butylsulfamoyl)prop-2-enamide

C7H14N2O3S — CID 154372421

IUPAC2-(butylsulfamoyl)prop-2-enamide
SMILESC=C(C(N)=O)S(=O)(=O)NCCCC
InChIInChI=1S/C7H14N2O3S/c1-3-4-5-9-13(11,12)6(2)7(8)10/h9H,2-5H2,1H3,(H2,8,10)
InChIKeyHWJXPCTUYDJHBF-UHFFFAOYSA-N
MW206.27 g/mol
LogP-0.30
Rot. Bonds6

About 2-(butylsulfamoyl)prop-2-enamide

2-(butylsulfamoyl)prop-2-enamide (PubChem CID 154372421) has the molecular formula C7H14N2O3S and a molecular weight of 206.27 g/mol. Its IUPAC name is 2-(butylsulfamoyl)prop-2-enamide.

Molecular Properties

Compound Name2-(butylsulfamoyl)prop-2-enamide
PubChem CID154372421
Molecular FormulaC7H14N2O3S
Molecular Weight206.27 g/mol
Exact Mass206.07
IUPAC Name2-(butylsulfamoyl)prop-2-enamide
SMILESC=C(C(N)=O)S(=O)(=O)NCCCC
InChIInChI=1S/C7H14N2O3S/c1-3-4-5-9-13(11,12)6(2)7(8)10/h9H,2-5H2,1H3,(H2,8,10)
InChIKeyHWJXPCTUYDJHBF-UHFFFAOYSA-N
XLogP-0.30
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(butylsulfamoyl)prop-2-enamide?
The IUPAC name of 2-(butylsulfamoyl)prop-2-enamide (CID 154372421) is 2-(butylsulfamoyl)prop-2-enamide.
What is the SMILES notation for 2-(butylsulfamoyl)prop-2-enamide?
The canonical SMILES for 2-(butylsulfamoyl)prop-2-enamide is C=C(C(N)=O)S(=O)(=O)NCCCC.
What is the InChIKey of 2-(butylsulfamoyl)prop-2-enamide?
The InChIKey is HWJXPCTUYDJHBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O3S/c1-3-4-5-9-13(11,12)6(2)7(8)10/h9H,2-5H2,1H3,(H2,8,10).
What are the key properties of 2-(butylsulfamoyl)prop-2-enamide?
2-(butylsulfamoyl)prop-2-enamide has a molecular weight of 206.27 g/mol, XLogP of -0.30, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butylsulfamoyl)prop-2-enamide is sourced from PubChem (CID 154372421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).