2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide

C15H22N2O5S — CID 108562538

IUPAC2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide
SMILESCOCC(=O)NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1
InChIInChI=1S/C15H22N2O5S/c1-21-11-15(18)16-12-7-9-17(10-8-12)23(19,20)14-5-3-13(22-2)4-6-14/h3-6,12H,7-11H2,1-2H3,(H,16,18)
InChIKeyPIYDZWICPVTNMK-UHFFFAOYSA-N
MW342.42 g/mol
LogP0.61
Rot. Bonds6

About 2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide

2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide (PubChem CID 108562538) has the molecular formula C15H22N2O5S and a molecular weight of 342.42 g/mol. Its IUPAC name is 2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide
PubChem CID108562538
Molecular FormulaC15H22N2O5S
Molecular Weight342.42 g/mol
Exact Mass342.12
IUPAC Name2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide
SMILESCOCC(=O)NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1
InChIInChI=1S/C15H22N2O5S/c1-21-11-15(18)16-12-7-9-17(10-8-12)23(19,20)14-5-3-13(22-2)4-6-14/h3-6,12H,7-11H2,1-2H3,(H,16,18)
InChIKeyPIYDZWICPVTNMK-UHFFFAOYSA-N
XLogP0.61
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-(cyclopropylamino)-2-oxoethyl] 1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxylate
CID 41049470
N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-4-methylpentanamide
CID 25465668
2-(3,4-dimethylphenoxy)-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide
CID 41171859
N-cyclopropyl-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]acetamide
CID 17376128
N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-3-[(2-phenylacetyl)amino]propanamide
CID 24611994
N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-4-methylsulfonylbenzamide
CID 41171707
N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-2-sulfanylbenzamide
CID 108561601
3-(3-chloro-4-methylphenyl)-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]propanamide
CID 24611977
2-methoxy-N-[1-(4-methoxybenzoyl)piperidin-4-yl]acetamide
CID 108557132
N-cyclohexyl-2-[4-(4-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]acetamide
CID 52920699
methyl 1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxylate
CID 737721
N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 24611970

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide?
The IUPAC name of 2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide (CID 108562538) is 2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide.
What is the SMILES notation for 2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide?
The canonical SMILES for 2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide is COCC(=O)NC1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1.
What is the InChIKey of 2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide?
The InChIKey is PIYDZWICPVTNMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O5S/c1-21-11-15(18)16-12-7-9-17(10-8-12)23(19,20)14-5-3-13(22-2)4-6-14/h3-6,12H,7-11H2,1-2H3,(H,16,18).
What are the key properties of 2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide?
2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide has a molecular weight of 342.42 g/mol, XLogP of 0.61, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]acetamide is sourced from PubChem (CID 108562538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).