3-(benzenesulfonamido)-N,N-dipropylbenzamide

C19H24N2O3S — CID 30282516

IUPAC3-(benzenesulfonamido)-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C19H24N2O3S/c1-3-13-21(14-4-2)19(22)16-9-8-10-17(15-16)20-25(23,24)18-11-6-5-7-12-18/h5-12,15,20H,3-4,13-14H2,1-2H3
InChIKeyIXQCFPOEVDRIGB-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.75
Rot. Bonds8

About 3-(benzenesulfonamido)-N,N-dipropylbenzamide

3-(benzenesulfonamido)-N,N-dipropylbenzamide (PubChem CID 30282516) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is 3-(benzenesulfonamido)-N,N-dipropylbenzamide.

Molecular Properties

Compound Name3-(benzenesulfonamido)-N,N-dipropylbenzamide
PubChem CID30282516
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC Name3-(benzenesulfonamido)-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C19H24N2O3S/c1-3-13-21(14-4-2)19(22)16-9-8-10-17(15-16)20-25(23,24)18-11-6-5-7-12-18/h5-12,15,20H,3-4,13-14H2,1-2H3
InChIKeyIXQCFPOEVDRIGB-UHFFFAOYSA-N
XLogP3.75
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[3-(benzenesulfonamido)benzoyl]-propan-2-ylamino]propanoic acid
CID 119206826
3-(benzenesulfonamido)-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide
CID 32954431
N-[2-(dimethylamino)ethyl]-3-[(4-fluorophenyl)sulfamoyl]-N-propylbenzamide
CID 86892169
2-[propyl-[3-(thiophen-2-ylsulfonylamino)benzoyl]amino]acetic acid
CID 119205119
3-(benzenesulfonamido)-N-[2-(ethylamino)-2-oxoethyl]benzamide
CID 18137070
3-(benzenesulfonamido)-N-[2-(dimethylamino)-2-oxoethyl]benzamide
CID 9305703
3-[(4-ethylphenyl)sulfonylamino]-N,N-dimethylbenzamide
CID 24629312
3-(benzenesulfonamido)-N-cyclohexyl-N-methylbenzamide
CID 27670732
N,N-dipropyl-3-(prop-2-ynylsulfamoyl)benzamide
CID 38550193
2-(benzenesulfonamido)-3-N,3-N-dipropylbenzene-1,3-dicarboxamide
CID 149253003
3-[[4-(dimethylamino)phenyl]sulfamoyl]-N,N-diethylbenzamide
CID 109065116
3-(benzenesulfonamido)-N-[(3-chlorophenyl)methyl]-N-methylbenzamide
CID 24660209

Frequently Asked Questions

What is the IUPAC name of 3-(benzenesulfonamido)-N,N-dipropylbenzamide?
The IUPAC name of 3-(benzenesulfonamido)-N,N-dipropylbenzamide (CID 30282516) is 3-(benzenesulfonamido)-N,N-dipropylbenzamide.
What is the SMILES notation for 3-(benzenesulfonamido)-N,N-dipropylbenzamide?
The canonical SMILES for 3-(benzenesulfonamido)-N,N-dipropylbenzamide is CCCN(CCC)C(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1.
What is the InChIKey of 3-(benzenesulfonamido)-N,N-dipropylbenzamide?
The InChIKey is IXQCFPOEVDRIGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-3-13-21(14-4-2)19(22)16-9-8-10-17(15-16)20-25(23,24)18-11-6-5-7-12-18/h5-12,15,20H,3-4,13-14H2,1-2H3.
What are the key properties of 3-(benzenesulfonamido)-N,N-dipropylbenzamide?
3-(benzenesulfonamido)-N,N-dipropylbenzamide has a molecular weight of 360.48 g/mol, XLogP of 3.75, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzenesulfonamido)-N,N-dipropylbenzamide is sourced from PubChem (CID 30282516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).