4-(dipropylsulfamoyl)-N-methylbenzamide

C14H22N2O3S — CID 17413757

IUPAC4-(dipropylsulfamoyl)-N-methylbenzamide
SMILESCCCN(CCC)S(=O)(=O)c1ccc(C(=O)NC)cc1
InChIInChI=1S/C14H22N2O3S/c1-4-10-16(11-5-2)20(18,19)13-8-6-12(7-9-13)14(17)15-3/h6-9H,4-5,10-11H2,1-3H3,(H,15,17)
InChIKeyOMFMVJIFYJSQOU-UHFFFAOYSA-N
MW298.41 g/mol
LogP1.86
Rot. Bonds7

About 4-(dipropylsulfamoyl)-N-methylbenzamide

4-(dipropylsulfamoyl)-N-methylbenzamide (PubChem CID 17413757) has the molecular formula C14H22N2O3S and a molecular weight of 298.41 g/mol. Its IUPAC name is 4-(dipropylsulfamoyl)-N-methylbenzamide.

Molecular Properties

Compound Name4-(dipropylsulfamoyl)-N-methylbenzamide
PubChem CID17413757
Molecular FormulaC14H22N2O3S
Molecular Weight298.41 g/mol
Exact Mass298.14
IUPAC Name4-(dipropylsulfamoyl)-N-methylbenzamide
SMILESCCCN(CCC)S(=O)(=O)c1ccc(C(=O)NC)cc1
InChIInChI=1S/C14H22N2O3S/c1-4-10-16(11-5-2)20(18,19)13-8-6-12(7-9-13)14(17)15-3/h6-9H,4-5,10-11H2,1-3H3,(H,15,17)
InChIKeyOMFMVJIFYJSQOU-UHFFFAOYSA-N
XLogP1.86
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(dipropylsulfamoyl)-N-methylbenzamide?
The IUPAC name of 4-(dipropylsulfamoyl)-N-methylbenzamide (CID 17413757) is 4-(dipropylsulfamoyl)-N-methylbenzamide.
What is the SMILES notation for 4-(dipropylsulfamoyl)-N-methylbenzamide?
The canonical SMILES for 4-(dipropylsulfamoyl)-N-methylbenzamide is CCCN(CCC)S(=O)(=O)c1ccc(C(=O)NC)cc1.
What is the InChIKey of 4-(dipropylsulfamoyl)-N-methylbenzamide?
The InChIKey is OMFMVJIFYJSQOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3S/c1-4-10-16(11-5-2)20(18,19)13-8-6-12(7-9-13)14(17)15-3/h6-9H,4-5,10-11H2,1-3H3,(H,15,17).
What are the key properties of 4-(dipropylsulfamoyl)-N-methylbenzamide?
4-(dipropylsulfamoyl)-N-methylbenzamide has a molecular weight of 298.41 g/mol, XLogP of 1.86, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dipropylsulfamoyl)-N-methylbenzamide is sourced from PubChem (CID 17413757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).