N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide

C24H26N4O4S — CID 24653440

IUPACN-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N2CCC(NC(=O)Cc3cccc4cccnc34)CC2)cc1
InChIInChI=1S/C24H26N4O4S/c1-17(29)26-20-7-9-22(10-8-20)33(31,32)28-14-11-21(12-15-28)27-23(30)16-19-5-2-4-18-6-3-13-25-24(18)19/h2-10,13,21H,11-12,14-16H2,1H3,(H,26,29)(H,27,30)
InChIKeyGHWIHCPRLBJKOK-UHFFFAOYSA-N
MW466.56 g/mol
LogP2.71
Rot. Bonds6

About N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide

N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide (PubChem CID 24653440) has the molecular formula C24H26N4O4S and a molecular weight of 466.56 g/mol. Its IUPAC name is N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide.

Molecular Properties

Compound NameN-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide
PubChem CID24653440
Molecular FormulaC24H26N4O4S
Molecular Weight466.56 g/mol
Exact Mass466.17
IUPAC NameN-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N2CCC(NC(=O)Cc3cccc4cccnc34)CC2)cc1
InChIInChI=1S/C24H26N4O4S/c1-17(29)26-20-7-9-22(10-8-20)33(31,32)28-14-11-21(12-15-28)27-23(30)16-19-5-2-4-18-6-3-13-25-24(18)19/h2-10,13,21H,11-12,14-16H2,1H3,(H,26,29)(H,27,30)
InChIKeyGHWIHCPRLBJKOK-UHFFFAOYSA-N
XLogP2.71
TPSA108.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500466.56
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[4-(pyridin-2-ylamino)piperidin-1-yl]sulfonylphenyl]acetamide
CID 167788841
N-[4-[4-(methylamino)piperidin-1-yl]sulfonylphenyl]acetamide
CID 60819644
N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-(3-chlorophenoxy)acetamide
CID 24614355
2-[4-(4-acetamidophenyl)sulfonylpiperazin-1-ium-1-yl]-N-cyclopentylacetamide
CID 7205951
N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-(5,6-dimethyl-1-benzofuran-3-yl)acetamide
CID 41368529
N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2,2,2-trifluoroacetamide
CID 108559105
N-[4-[4-[(4-methylphenyl)carbamoylamino]piperidin-1-yl]sulfonylphenyl]acetamide
CID 24612546
N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-3-methylbenzamide
CID 108561834
N-[3-[acetyl(methyl)amino]cyclohexyl]-2-quinolin-8-ylacetamide
CID 166373675
N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-(2,4-dioxopyrimidin-1-yl)acetamide
CID 24614392
N-methyl-1-(quinolin-8-ylmethylsulfonyl)piperidin-4-amine
CID 119980282
N-[4-[4-[(2-methoxyphenyl)carbamoylamino]piperidin-1-yl]sulfonylphenyl]acetamide
CID 24612547

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide?
The IUPAC name of N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide (CID 24653440) is N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide.
What is the SMILES notation for N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide?
The canonical SMILES for N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide is CC(=O)Nc1ccc(S(=O)(=O)N2CCC(NC(=O)Cc3cccc4cccnc34)CC2)cc1.
What is the InChIKey of N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide?
The InChIKey is GHWIHCPRLBJKOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O4S/c1-17(29)26-20-7-9-22(10-8-20)33(31,32)28-14-11-21(12-15-28)27-23(30)16-19-5-2-4-18-6-3-13-25-24(18)19/h2-10,13,21H,11-12,14-16H2,1H3,(H,26,29)(H,27,30).
What are the key properties of N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide?
N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide has a molecular weight of 466.56 g/mol, XLogP of 2.71, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-quinolin-8-ylacetamide is sourced from PubChem (CID 24653440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).