N-(propylsulfamoyl)prop-2-enamide

C6H12N2O3S — CID 154223157

IUPACN-(propylsulfamoyl)prop-2-enamide
SMILESC=CC(=O)NS(=O)(=O)NCCC
InChIInChI=1S/C6H12N2O3S/c1-3-5-7-12(10,11)8-6(9)4-2/h4,7H,2-3,5H2,1H3,(H,8,9)
InChIKeyHOIKDMXIEVYLGF-UHFFFAOYSA-N
MW192.24 g/mol
LogP-0.47
Rot. Bonds5

About N-(propylsulfamoyl)prop-2-enamide

N-(propylsulfamoyl)prop-2-enamide (PubChem CID 154223157) has the molecular formula C6H12N2O3S and a molecular weight of 192.24 g/mol. Its IUPAC name is N-(propylsulfamoyl)prop-2-enamide.

Molecular Properties

Compound NameN-(propylsulfamoyl)prop-2-enamide
PubChem CID154223157
Molecular FormulaC6H12N2O3S
Molecular Weight192.24 g/mol
Exact Mass192.06
IUPAC NameN-(propylsulfamoyl)prop-2-enamide
SMILESC=CC(=O)NS(=O)(=O)NCCC
InChIInChI=1S/C6H12N2O3S/c1-3-5-7-12(10,11)8-6(9)4-2/h4,7H,2-3,5H2,1H3,(H,8,9)
InChIKeyHOIKDMXIEVYLGF-UHFFFAOYSA-N
XLogP-0.47
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 5-0.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-butylsulfonylprop-2-enamide
CID 130339621
ethyl N-(propylsulfamoyl)carbamate
CID 114463072
molecular hydrogen;N-propylprop-2-enamide
CID 153372503
prop-2-enoylsulfamoyl propanoate
CID 174441844
N,N-dimethylmethanamine;N-propylprop-2-enamide;hydrochloride
CID 173003472
N-[4-(propylamino)butyl]prop-2-enamide
CID 87503940
N-butylbutan-1-amine;N-propylprop-2-enamide
CID 22596638
5-(propylsulfamoylamino)pentanoic acid
CID 114806222
N-butylprop-2-enamide;hydrofluoride
CID 174533496
propyl N-[3-(prop-2-enoylamino)propyl]sulfamate
CID 175159228
ethyl 2-(propylsulfamoylamino)acetate
CID 59773974
N-heptadecylprop-2-enamide
CID 20727742

Frequently Asked Questions

What is the IUPAC name of N-(propylsulfamoyl)prop-2-enamide?
The IUPAC name of N-(propylsulfamoyl)prop-2-enamide (CID 154223157) is N-(propylsulfamoyl)prop-2-enamide.
What is the SMILES notation for N-(propylsulfamoyl)prop-2-enamide?
The canonical SMILES for N-(propylsulfamoyl)prop-2-enamide is C=CC(=O)NS(=O)(=O)NCCC.
What is the InChIKey of N-(propylsulfamoyl)prop-2-enamide?
The InChIKey is HOIKDMXIEVYLGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O3S/c1-3-5-7-12(10,11)8-6(9)4-2/h4,7H,2-3,5H2,1H3,(H,8,9).
What are the key properties of N-(propylsulfamoyl)prop-2-enamide?
N-(propylsulfamoyl)prop-2-enamide has a molecular weight of 192.24 g/mol, XLogP of -0.47, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(propylsulfamoyl)prop-2-enamide is sourced from PubChem (CID 154223157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).