N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide

C20H24N2O5S — CID 108562882

IUPACN-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide
SMILESCCc1ccc(S(=O)(=O)N2CCC(NC(=O)c3cc(O)cc(O)c3)CC2)cc1
InChIInChI=1S/C20H24N2O5S/c1-2-14-3-5-19(6-4-14)28(26,27)22-9-7-16(8-10-22)21-20(25)15-11-17(23)13-18(24)12-15/h3-6,11-13,16,23-24H,2,7-10H2,1H3,(H,21,25)
InChIKeySGBMABCHYBAVGQ-UHFFFAOYSA-N
MW404.49 g/mol
LogP2.24
Rot. Bonds5

About N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide

N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide (PubChem CID 108562882) has the molecular formula C20H24N2O5S and a molecular weight of 404.49 g/mol. Its IUPAC name is N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide.

Molecular Properties

Compound NameN-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide
PubChem CID108562882
Molecular FormulaC20H24N2O5S
Molecular Weight404.49 g/mol
Exact Mass404.14
IUPAC NameN-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide
SMILESCCc1ccc(S(=O)(=O)N2CCC(NC(=O)c3cc(O)cc(O)c3)CC2)cc1
InChIInChI=1S/C20H24N2O5S/c1-2-14-3-5-19(6-4-14)28(26,27)22-9-7-16(8-10-22)21-20(25)15-11-17(23)13-18(24)12-15/h3-6,11-13,16,23-24H,2,7-10H2,1H3,(H,21,25)
InChIKeySGBMABCHYBAVGQ-UHFFFAOYSA-N
XLogP2.24
TPSA106.94 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.49
LogP ≤ 52.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,5-dihydroxy-N-[1-(4-nitrophenyl)sulfonylpiperidin-4-yl]benzamide
CID 108562893
N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,4-dimethoxybenzamide
CID 108559133
3-hydroxy-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]benzamide
CID 108562939
N-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]benzamide
CID 51294911
N-(1-ethylpiperidin-4-yl)-4-pyrrolidin-1-ylsulfonylbenzamide
CID 9091107
N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-3,4,5-trihydroxybenzamide
CID 108560172
N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-3,5-bis(trifluoromethyl)benzamide
CID 24609608
3,4,5-trimethoxy-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]benzamide
CID 26073704
N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3-phenoxypropanamide
CID 108561671
2-(2,4-dimethylphenoxy)-N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]acetamide
CID 108559998
N-[1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]-4-methylbenzamide
CID 108559241
3,4-difluoro-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]benzamide
CID 24617746

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide?
The IUPAC name of N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide (CID 108562882) is N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide.
What is the SMILES notation for N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide?
The canonical SMILES for N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide is CCc1ccc(S(=O)(=O)N2CCC(NC(=O)c3cc(O)cc(O)c3)CC2)cc1.
What is the InChIKey of N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide?
The InChIKey is SGBMABCHYBAVGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O5S/c1-2-14-3-5-19(6-4-14)28(26,27)22-9-7-16(8-10-22)21-20(25)15-11-17(23)13-18(24)12-15/h3-6,11-13,16,23-24H,2,7-10H2,1H3,(H,21,25).
What are the key properties of N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide?
N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide has a molecular weight of 404.49 g/mol, XLogP of 2.24, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]-3,5-dihydroxybenzamide is sourced from PubChem (CID 108562882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).