N-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide

C20H25N3O4S — CID 9083951

IUPACN-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide
SMILESCOc1ccccc1NC(=O)CNc1ccc(S(=O)(=O)N2CCCCC2)cc1
InChIInChI=1S/C20H25N3O4S/c1-27-19-8-4-3-7-18(19)22-20(24)15-21-16-9-11-17(12-10-16)28(25,26)23-13-5-2-6-14-23/h3-4,7-12,21H,2,5-6,13-15H2,1H3,(H,22,24)
InChIKeyRWVOQLCCJOTMJW-UHFFFAOYSA-N
MW403.50 g/mol
LogP2.92
Rot. Bonds7

About N-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide

N-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide (PubChem CID 9083951) has the molecular formula C20H25N3O4S and a molecular weight of 403.50 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide
PubChem CID9083951
Molecular FormulaC20H25N3O4S
Molecular Weight403.50 g/mol
Exact Mass403.16
IUPAC NameN-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide
SMILESCOc1ccccc1NC(=O)CNc1ccc(S(=O)(=O)N2CCCCC2)cc1
InChIInChI=1S/C20H25N3O4S/c1-27-19-8-4-3-7-18(19)22-20(24)15-21-16-9-11-17(12-10-16)28(25,26)23-13-5-2-6-14-23/h3-4,7-12,21H,2,5-6,13-15H2,1H3,(H,22,24)
InChIKeyRWVOQLCCJOTMJW-UHFFFAOYSA-N
XLogP2.92
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.50
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-methoxyanilino)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 9080500
N-(2-methoxyphenyl)-2-(4-methyl-3-piperidin-1-ylsulfonylanilino)acetamide
CID 9100423
2-(4-fluoroanilino)-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)acetamide
CID 9098686
N-(2,5-dimethoxyphenyl)-2-(4-pyrrolidin-1-ylsulfonylanilino)acetamide
CID 9083617
N-(2-fluorophenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide
CID 9083962
N-(3-chloro-2-methylphenyl)-2-(4-pyrrolidin-1-ylsulfonylanilino)acetamide
CID 9083596
ethyl 4-[[2-(2-methoxy-5-piperidin-1-ylsulfonylanilino)-2-oxoethyl]amino]benzoate
CID 24614979
1-(2-methoxyphenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea
CID 19680447
2-[4-(azepan-1-ylsulfonyl)anilino]-N-(4-methylphenyl)acetamide
CID 31054307
N-(2-methoxy-5-methylphenyl)-2-(3-piperidin-1-ylsulfonylanilino)acetamide
CID 9083438
2-[3-(azepan-1-ylsulfonyl)anilino]-N-(2,4-dimethoxyphenyl)acetamide
CID 42996635
2-(naphthalen-1-ylamino)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 9082352

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide?
The IUPAC name of N-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide (CID 9083951) is N-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide.
What is the SMILES notation for N-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide?
The canonical SMILES for N-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide is COc1ccccc1NC(=O)CNc1ccc(S(=O)(=O)N2CCCCC2)cc1.
What is the InChIKey of N-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide?
The InChIKey is RWVOQLCCJOTMJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O4S/c1-27-19-8-4-3-7-18(19)22-20(24)15-21-16-9-11-17(12-10-16)28(25,26)23-13-5-2-6-14-23/h3-4,7-12,21H,2,5-6,13-15H2,1H3,(H,22,24).
What are the key properties of N-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide?
N-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide has a molecular weight of 403.50 g/mol, XLogP of 2.92, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylanilino)acetamide is sourced from PubChem (CID 9083951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).