N-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide

C23H31N3O5S — CID 41014795

IUPACN-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide
SMILESCOc1ccc([C@@H](CNS(=O)(=O)c2ccc(NC(C)=O)c(OC)c2)N2CCCCC2)cc1
InChIInChI=1S/C23H31N3O5S/c1-17(27)25-21-12-11-20(15-23(21)31-3)32(28,29)24-16-22(26-13-5-4-6-14-26)18-7-9-19(30-2)10-8-18/h7-12,15,22,24H,4-6,13-14,16H2,1-3H3,(H,25,27)/t22-/m1/s1
InChIKeyYXYHRCNWZCUDNL-JOCHJYFZSA-N
MW461.58 g/mol
LogP3.17
Rot. Bonds9

About N-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide

N-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide (PubChem CID 41014795) has the molecular formula C23H31N3O5S and a molecular weight of 461.58 g/mol. Its IUPAC name is N-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide
PubChem CID41014795
Molecular FormulaC23H31N3O5S
Molecular Weight461.58 g/mol
Exact Mass461.20
IUPAC NameN-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide
SMILESCOc1ccc([C@@H](CNS(=O)(=O)c2ccc(NC(C)=O)c(OC)c2)N2CCCCC2)cc1
InChIInChI=1S/C23H31N3O5S/c1-17(27)25-21-12-11-20(15-23(21)31-3)32(28,29)24-16-22(26-13-5-4-6-14-26)18-7-9-19(30-2)10-8-18/h7-12,15,22,24H,4-6,13-14,16H2,1-3H3,(H,25,27)/t22-/m1/s1
InChIKeyYXYHRCNWZCUDNL-JOCHJYFZSA-N
XLogP3.17
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.58
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide 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

N-[4-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 2468130
4-bromo-N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]benzenesulfonamide
CID 16553768
4-chloro-N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzenesulfonamide
CID 42912923
2,5-dimethoxy-N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzenesulfonamide
CID 55352494
3-chloro-N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzenesulfonamide
CID 31481673
N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-methyl-3-nitrobenzenesulfonamide
CID 31481771
4-cyano-N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzenesulfonamide
CID 51169277
4-methoxy-N-[2-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)ethyl]-3-methylbenzenesulfonamide
CID 16812930
2-methoxy-N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-5-nitrobenzenesulfonamide
CID 46457579
3-bromo-4-methoxy-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzenesulfonamide
CID 55353294
N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-2,4-dimethylbenzenesulfonamide
CID 46799908
N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-2,5-dimethylbenzenesulfonamide
CID 26942652

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide (CID 41014795) is N-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide is COc1ccc([C@@H](CNS(=O)(=O)c2ccc(NC(C)=O)c(OC)c2)N2CCCCC2)cc1.
What is the InChIKey of N-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide?
The InChIKey is YXYHRCNWZCUDNL-JOCHJYFZSA-N. The full InChI is InChI=1S/C23H31N3O5S/c1-17(27)25-21-12-11-20(15-23(21)31-3)32(28,29)24-16-22(26-13-5-4-6-14-26)18-7-9-19(30-2)10-8-18/h7-12,15,22,24H,4-6,13-14,16H2,1-3H3,(H,25,27)/t22-/m1/s1.
What are the key properties of N-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide?
N-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide has a molecular weight of 461.58 g/mol, XLogP of 3.17, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-4-[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 41014795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).