4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide

C22H25N3O3S — CID 132575418

IUPAC4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide
SMILESCCCN(CCC)S(=O)(=O)c1ccc(C(=O)Nc2cccc3cccnc23)cc1
InChIInChI=1S/C22H25N3O3S/c1-3-15-25(16-4-2)29(27,28)19-12-10-18(11-13-19)22(26)24-20-9-5-7-17-8-6-14-23-21(17)20/h5-14H,3-4,15-16H2,1-2H3,(H,24,26)
InChIKeySXGILYHUAKMTCW-UHFFFAOYSA-N
MW411.53 g/mol
LogP4.30
Rot. Bonds8

About 4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide

4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide (PubChem CID 132575418) has the molecular formula C22H25N3O3S and a molecular weight of 411.53 g/mol. Its IUPAC name is 4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide.

Molecular Properties

Compound Name4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide
PubChem CID132575418
Molecular FormulaC22H25N3O3S
Molecular Weight411.53 g/mol
Exact Mass411.16
IUPAC Name4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide
SMILESCCCN(CCC)S(=O)(=O)c1ccc(C(=O)Nc2cccc3cccnc23)cc1
InChIInChI=1S/C22H25N3O3S/c1-3-15-25(16-4-2)29(27,28)19-12-10-18(11-13-19)22(26)24-20-9-5-7-17-8-6-14-23-21(17)20/h5-14H,3-4,15-16H2,1-2H3,(H,24,26)
InChIKeySXGILYHUAKMTCW-UHFFFAOYSA-N
XLogP4.30
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.53
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(dipropylsulfamoyl)-N-(2-methylphenyl)benzamide
CID 3936209
6-(dipropylamino)-N-quinolin-8-ylpyridine-3-carboxamide
CID 109161849
4-(tert-butylsulfamoyl)-N-quinolin-8-ylbenzamide
CID 31542150
4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide
CID 31321858
4-(methylsulfanylmethyl)-N-quinolin-8-ylbenzamide
CID 31289054
3-[methyl(propan-2-yl)sulfamoyl]-N-quinolin-8-ylbenzamide
CID 26123442
3,4,5-triethoxy-N-quinolin-8-ylbenzamide
CID 1018003
4-(acetamidomethyl)-N-quinolin-8-ylbenzamide
CID 18196066
4-morpholin-4-ylsulfonyl-N-quinolin-8-ylbenzamide
CID 26123616
4-(dipropylsulfamoyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)benzamide
CID 4614245
4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-quinolin-8-ylbenzamide
CID 42906884
4-[[4-(dipropylsulfamoyl)benzoyl]amino]-N-methyl-1H-pyrazole-5-carboxamide
CID 69381656

Frequently Asked Questions

What is the IUPAC name of 4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide?
The IUPAC name of 4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide (CID 132575418) is 4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide.
What is the SMILES notation for 4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide?
The canonical SMILES for 4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide is CCCN(CCC)S(=O)(=O)c1ccc(C(=O)Nc2cccc3cccnc23)cc1.
What is the InChIKey of 4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide?
The InChIKey is SXGILYHUAKMTCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O3S/c1-3-15-25(16-4-2)29(27,28)19-12-10-18(11-13-19)22(26)24-20-9-5-7-17-8-6-14-23-21(17)20/h5-14H,3-4,15-16H2,1-2H3,(H,24,26).
What are the key properties of 4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide?
4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide has a molecular weight of 411.53 g/mol, XLogP of 4.30, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dipropylsulfamoyl)-N-quinolin-8-ylbenzamide is sourced from PubChem (CID 132575418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).