N-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide

C21H25N3O5S — CID 108563478

IUPACN-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide
SMILESCOc1ccc(C(=O)N2CCC(NS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1
InChIInChI=1S/C21H25N3O5S/c1-15(25)22-17-5-9-20(10-6-17)30(27,28)23-18-11-13-24(14-12-18)21(26)16-3-7-19(29-2)8-4-16/h3-10,18,23H,11-14H2,1-2H3,(H,22,25)
InChIKeyNJHJLRKCFABQNF-UHFFFAOYSA-N
MW431.51 g/mol
LogP2.24
Rot. Bonds6

About N-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide

N-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide (PubChem CID 108563478) has the molecular formula C21H25N3O5S and a molecular weight of 431.51 g/mol. Its IUPAC name is N-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide
PubChem CID108563478
Molecular FormulaC21H25N3O5S
Molecular Weight431.51 g/mol
Exact Mass431.15
IUPAC NameN-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide
SMILESCOc1ccc(C(=O)N2CCC(NS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1
InChIInChI=1S/C21H25N3O5S/c1-15(25)22-17-5-9-20(10-6-17)30(27,28)23-18-11-13-24(14-12-18)21(26)16-3-7-19(29-2)8-4-16/h3-10,18,23H,11-14H2,1-2H3,(H,22,25)
InChIKeyNJHJLRKCFABQNF-UHFFFAOYSA-N
XLogP2.24
TPSA104.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.51
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[[1-(4-chlorobenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide
CID 108563915
4-methoxy-N-[1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl]benzenesulfonamide
CID 50823789
N-[1-(4-methoxybenzoyl)piperidin-4-yl]-4-nitrobenzenesulfonamide
CID 108563476
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-methoxybenzenesulfonamide
CID 50823745
N-cyclopentyl-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]benzenesulfonamide
CID 3226941
4-(4-aminopiperidine-1-carbonyl)-N-(4-methoxyphenyl)benzenesulfonamide
CID 119374457
N-[1-(2,4-dimethylbenzoyl)piperidin-4-yl]-4-methoxybenzenesulfonamide
CID 50823683
4-methoxy-N-(1-propanoylpiperidin-4-yl)benzenesulfonamide
CID 110819170
N-[1-(4-ethoxybenzoyl)piperidin-4-yl]-4-methylbenzenesulfonamide
CID 17497600
N-[1-(4-methoxybenzoyl)piperidin-4-yl]-2,5-dimethylbenzenesulfonamide
CID 108563470
N-[4-[[1-(pyrazine-2-carbonyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide
CID 108566860
N-[1-(3,4-dimethoxybenzoyl)piperidin-4-yl]-4-ethoxybenzenesulfonamide
CID 108563446

Frequently Asked Questions

What is the IUPAC name of N-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide (CID 108563478) is N-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide is COc1ccc(C(=O)N2CCC(NS(=O)(=O)c3ccc(NC(C)=O)cc3)CC2)cc1.
What is the InChIKey of N-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide?
The InChIKey is NJHJLRKCFABQNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O5S/c1-15(25)22-17-5-9-20(10-6-17)30(27,28)23-18-11-13-24(14-12-18)21(26)16-3-7-19(29-2)8-4-16/h3-10,18,23H,11-14H2,1-2H3,(H,22,25).
What are the key properties of N-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide?
N-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide has a molecular weight of 431.51 g/mol, XLogP of 2.24, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[1-(4-methoxybenzoyl)piperidin-4-yl]sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 108563478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).