4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide

C18H23N3O3S — CID 17385730

IUPAC4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide
SMILESCCCN(CCC)S(=O)(=O)c1ccc(C(=O)Nc2ccccn2)cc1
InChIInChI=1S/C18H23N3O3S/c1-3-13-21(14-4-2)25(23,24)16-10-8-15(9-11-16)18(22)20-17-7-5-6-12-19-17/h5-12H,3-4,13-14H2,1-2H3,(H,19,20,22)
InChIKeyHOEQKFRDLOUDDS-UHFFFAOYSA-N
MW361.47 g/mol
LogP3.14
Rot. Bonds8

About 4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide

4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide (PubChem CID 17385730) has the molecular formula C18H23N3O3S and a molecular weight of 361.47 g/mol. Its IUPAC name is 4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide.

Molecular Properties

Compound Name4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide
PubChem CID17385730
Molecular FormulaC18H23N3O3S
Molecular Weight361.47 g/mol
Exact Mass361.15
IUPAC Name4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide
SMILESCCCN(CCC)S(=O)(=O)c1ccc(C(=O)Nc2ccccn2)cc1
InChIInChI=1S/C18H23N3O3S/c1-3-13-21(14-4-2)25(23,24)16-10-8-15(9-11-16)18(22)20-17-7-5-6-12-19-17/h5-12H,3-4,13-14H2,1-2H3,(H,19,20,22)
InChIKeyHOEQKFRDLOUDDS-UHFFFAOYSA-N
XLogP3.14
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.47
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide?
The IUPAC name of 4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide (CID 17385730) is 4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide.
What is the SMILES notation for 4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide?
The canonical SMILES for 4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide is CCCN(CCC)S(=O)(=O)c1ccc(C(=O)Nc2ccccn2)cc1.
What is the InChIKey of 4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide?
The InChIKey is HOEQKFRDLOUDDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3S/c1-3-13-21(14-4-2)25(23,24)16-10-8-15(9-11-16)18(22)20-17-7-5-6-12-19-17/h5-12H,3-4,13-14H2,1-2H3,(H,19,20,22).
What are the key properties of 4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide?
4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide has a molecular weight of 361.47 g/mol, XLogP of 3.14, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dipropylsulfamoyl)-N-pyridin-2-ylbenzamide is sourced from PubChem (CID 17385730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).