1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide

C19H23ClN2O3S — CID 86966765

IUPAC1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide
SMILESCOc1ccccc1N1CCCC(NS(=O)(=O)Cc2ccccc2Cl)C1
InChIInChI=1S/C19H23ClN2O3S/c1-25-19-11-5-4-10-18(19)22-12-6-8-16(13-22)21-26(23,24)14-15-7-2-3-9-17(15)20/h2-5,7,9-11,16,21H,6,8,12-14H2,1H3
InChIKeyQKKOFWXIAXLYNQ-UHFFFAOYSA-N
MW394.92 g/mol
LogP3.44
Rot. Bonds6

About 1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide

1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide (PubChem CID 86966765) has the molecular formula C19H23ClN2O3S and a molecular weight of 394.92 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide.

Molecular Properties

Compound Name1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide
PubChem CID86966765
Molecular FormulaC19H23ClN2O3S
Molecular Weight394.92 g/mol
Exact Mass394.11
IUPAC Name1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide
SMILESCOc1ccccc1N1CCCC(NS(=O)(=O)Cc2ccccc2Cl)C1
InChIInChI=1S/C19H23ClN2O3S/c1-25-19-11-5-4-10-18(19)22-12-6-8-16(13-22)21-26(23,24)14-15-7-2-3-9-17(15)20/h2-5,7,9-11,16,21H,6,8,12-14H2,1H3
InChIKeyQKKOFWXIAXLYNQ-UHFFFAOYSA-N
XLogP3.44
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.92
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-difluoro-N-[1-(2-methoxyphenyl)piperidin-3-yl]benzenesulfonamide
CID 86966755
5-fluoro-N-[1-(2-methoxyphenyl)piperidin-3-yl]-2-methylbenzenesulfonamide
CID 86966758
2-(3-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]acetamide
CID 86965513
2-bromo-4-fluoro-N-[1-(2-methoxyphenyl)piperidin-3-yl]benzenesulfonamide
CID 86966763
N-[1-(2-methoxyphenyl)piperidin-3-yl]-2-methyl-3-nitrobenzenesulfonamide
CID 86966747
N-[1-(2-methoxyphenyl)piperidin-3-yl]-2-methyl-6-nitrobenzenesulfonamide
CID 86966778
3-chloro-4-ethoxy-5-methoxy-N-[1-(2-methoxyphenyl)piperidin-3-yl]benzamide
CID 86965528
2-cyclohexyl-N-[1-(2-methoxyphenyl)piperidin-3-yl]acetamide
CID 86965524
1-(2-chlorophenyl)-N-[1-(4-methoxyphenyl)-2-oxopyrrolidin-3-yl]methanesulfonamide
CID 53166772
2-hydroxy-N-[1-(2-methoxyphenyl)piperidin-3-yl]cyclopentane-1-carboxamide
CID 110015870
3-cyclopentyl-N-[1-(2-methoxyphenyl)piperidin-3-yl]propanamide
CID 86965679
N-[1-(2-methoxyphenyl)piperidin-3-yl]-2-phenylsulfanylpropanamide
CID 86965606

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide?
The IUPAC name of 1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide (CID 86966765) is 1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide.
What is the SMILES notation for 1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide?
The canonical SMILES for 1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide is COc1ccccc1N1CCCC(NS(=O)(=O)Cc2ccccc2Cl)C1.
What is the InChIKey of 1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide?
The InChIKey is QKKOFWXIAXLYNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O3S/c1-25-19-11-5-4-10-18(19)22-12-6-8-16(13-22)21-26(23,24)14-15-7-2-3-9-17(15)20/h2-5,7,9-11,16,21H,6,8,12-14H2,1H3.
What are the key properties of 1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide?
1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide has a molecular weight of 394.92 g/mol, XLogP of 3.44, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-N-[1-(2-methoxyphenyl)piperidin-3-yl]methanesulfonamide is sourced from PubChem (CID 86966765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).