N-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide

C14H20N2O3S — CID 833153

IUPACN-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)C2CC2)cc1
InChIInChI=1S/C14H20N2O3S/c1-3-16(4-2)20(18,19)13-9-7-12(8-10-13)15-14(17)11-5-6-11/h7-11H,3-6H2,1-2H3,(H,15,17)
InChIKeyKOGVMINLYFRULU-UHFFFAOYSA-N
MW296.39 g/mol
LogP2.07
Rot. Bonds6

About N-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide

N-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide (PubChem CID 833153) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is N-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide
PubChem CID833153
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC NameN-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)C2CC2)cc1
InChIInChI=1S/C14H20N2O3S/c1-3-16(4-2)20(18,19)13-9-7-12(8-10-13)15-14(17)11-5-6-11/h7-11H,3-6H2,1-2H3,(H,15,17)
InChIKeyKOGVMINLYFRULU-UHFFFAOYSA-N
XLogP2.07
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide (CID 833153) is N-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide is CCN(CC)S(=O)(=O)c1ccc(NC(=O)C2CC2)cc1.
What is the InChIKey of N-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide?
The InChIKey is KOGVMINLYFRULU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c1-3-16(4-2)20(18,19)13-9-7-12(8-10-13)15-14(17)11-5-6-11/h7-11H,3-6H2,1-2H3,(H,15,17).
What are the key properties of N-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide?
N-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide has a molecular weight of 296.39 g/mol, XLogP of 2.07, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylsulfamoyl)phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 833153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).