2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone

C10H19NO3 — CID 143192763

IUPAC2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone
SMILESCOCOCC(=O)N1CCC(C)CC1
InChIInChI=1S/C10H19NO3/c1-9-3-5-11(6-4-9)10(12)7-14-8-13-2/h9H,3-8H2,1-2H3
InChIKeyJUNDPNKMGWZMIS-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.87
Rot. Bonds4

About 2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone

2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone (PubChem CID 143192763) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone
PubChem CID143192763
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Name2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone
SMILESCOCOCC(=O)N1CCC(C)CC1
InChIInChI=1S/C10H19NO3/c1-9-3-5-11(6-4-9)10(12)7-14-8-13-2/h9H,3-8H2,1-2H3
InChIKeyJUNDPNKMGWZMIS-UHFFFAOYSA-N
XLogP0.87
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-ethoxy-1-(4-methylazepan-1-yl)ethanone
CID 62046305
2-aminooxy-1-(4-methylpiperidin-1-yl)ethanone
CID 83967675
2-methoxy-1-[(3S)-3-methylpyrrolidin-1-yl]ethanone
CID 145013525
2-(2-amino-2-methylpropoxy)-1-(4-methylpiperidin-1-yl)ethanone
CID 82353212
2-hydroxy-1-(4-methylpiperidin-1-yl)ethanone
CID 16769494
[2-(4-methylpiperidin-1-yl)-2-oxoethyl] thiocyanate
CID 21490093
1-(4-methylazepan-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone
CID 112605170
2-hydroxy-1-(4-methylpiperidin-1-yl)ethanone;propane
CID 153363552
2-(1-methylazetidin-3-yl)oxy-1-(4-methylpiperidin-1-yl)ethanone
CID 166537028
ethane;1-(4-methylpiperidin-1-yl)propan-1-one
CID 143648090
2-bromo-1-(4-methylpiperidin-1-yl)ethanone
CID 52984046
1-(3,5-dimethylpiperidin-1-yl)-2-(2-methoxyethoxy)ethanone
CID 103601586

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone?
The IUPAC name of 2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone (CID 143192763) is 2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone?
The canonical SMILES for 2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone is COCOCC(=O)N1CCC(C)CC1.
What is the InChIKey of 2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone?
The InChIKey is JUNDPNKMGWZMIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-9-3-5-11(6-4-9)10(12)7-14-8-13-2/h9H,3-8H2,1-2H3.
What are the key properties of 2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone?
2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone has a molecular weight of 201.27 g/mol, XLogP of 0.87, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethoxy)-1-(4-methylpiperidin-1-yl)ethanone is sourced from PubChem (CID 143192763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).