4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide

C19H25N3O3S — CID 109060953

IUPAC4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide
SMILESCCCN(CCC)S(=O)(=O)c1ccc(C(=O)NCc2ccncc2)cc1
InChIInChI=1S/C19H25N3O3S/c1-3-13-22(14-4-2)26(24,25)18-7-5-17(6-8-18)19(23)21-15-16-9-11-20-12-10-16/h5-12H,3-4,13-15H2,1-2H3,(H,21,23)
InChIKeyGNLFJIAGBUEYLW-UHFFFAOYSA-N
MW375.49 g/mol
LogP2.82
Rot. Bonds9

About 4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide

4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide (PubChem CID 109060953) has the molecular formula C19H25N3O3S and a molecular weight of 375.49 g/mol. Its IUPAC name is 4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide
PubChem CID109060953
Molecular FormulaC19H25N3O3S
Molecular Weight375.49 g/mol
Exact Mass375.16
IUPAC Name4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide
SMILESCCCN(CCC)S(=O)(=O)c1ccc(C(=O)NCc2ccncc2)cc1
InChIInChI=1S/C19H25N3O3S/c1-3-13-22(14-4-2)26(24,25)18-7-5-17(6-8-18)19(23)21-15-16-9-11-20-12-10-16/h5-12H,3-4,13-15H2,1-2H3,(H,21,23)
InChIKeyGNLFJIAGBUEYLW-UHFFFAOYSA-N
XLogP2.82
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.49
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[ethylsulfonyl(methyl)amino]-N-(pyridin-4-ylmethyl)benzamide
CID 17200575
4-N-butyl-4-N-methyl-1-N-(pyridin-4-ylmethyl)benzene-1,4-dicarboxamide
CID 109047745
4-(dipropylsulfamoyl)-N-(2-hydrazinyl-2-oxoethyl)benzamide
CID 43948656
N-[[4-[2-hydroxyethyl(propyl)sulfamoyl]phenyl]methyl]acetamide
CID 61425416
4-[methyl(methylsulfonyl)amino]-N-(pyridin-4-ylmethyl)benzamide
CID 900511
2-[methylsulfonyl(propyl)amino]-N-(pyridin-4-ylmethyl)acetamide
CID 113147492
4-(prop-2-enylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide
CID 45029526
6-(dipropylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 109158139
4-(dimethylsulfamoyl)-N-[(4-ethylphenyl)methyl]benzamide
CID 110779528
4-propoxy-N-(pyridin-4-ylmethyl)benzamide
CID 6459003
4-[(3,5-dimethylphenyl)sulfamoyl]-N-(pyridin-4-ylmethyl)benzamide
CID 109060958
4-propanoyl-N,N-dipropylbenzenesulfonamide
CID 70641695

Frequently Asked Questions

What is the IUPAC name of 4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide?
The IUPAC name of 4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide (CID 109060953) is 4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide.
What is the SMILES notation for 4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide?
The canonical SMILES for 4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide is CCCN(CCC)S(=O)(=O)c1ccc(C(=O)NCc2ccncc2)cc1.
What is the InChIKey of 4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide?
The InChIKey is GNLFJIAGBUEYLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3S/c1-3-13-22(14-4-2)26(24,25)18-7-5-17(6-8-18)19(23)21-15-16-9-11-20-12-10-16/h5-12H,3-4,13-15H2,1-2H3,(H,21,23).
What are the key properties of 4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide?
4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide has a molecular weight of 375.49 g/mol, XLogP of 2.82, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dipropylsulfamoyl)-N-(pyridin-4-ylmethyl)benzamide is sourced from PubChem (CID 109060953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).