2-(methoxymethyl)piperidin-4-one

C7H13NO2 — CID 82651344

IUPAC2-(methoxymethyl)piperidin-4-one
SMILESCOCC1CC(=O)CCN1
InChIInChI=1S/C7H13NO2/c1-10-5-6-4-7(9)2-3-8-6/h6,8H,2-5H2,1H3
InChIKeyMEOIKYBUPNARAE-UHFFFAOYSA-N
MW143.19 g/mol
LogP-0.05
Rot. Bonds2

About 2-(methoxymethyl)piperidin-4-one

2-(methoxymethyl)piperidin-4-one (PubChem CID 82651344) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is 2-(methoxymethyl)piperidin-4-one.

Molecular Properties

Compound Name2-(methoxymethyl)piperidin-4-one
PubChem CID82651344
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name2-(methoxymethyl)piperidin-4-one
SMILESCOCC1CC(=O)CCN1
InChIInChI=1S/C7H13NO2/c1-10-5-6-4-7(9)2-3-8-6/h6,8H,2-5H2,1H3
InChIKeyMEOIKYBUPNARAE-UHFFFAOYSA-N
XLogP-0.05
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethylazepan-4-one
CID 70067694
2-(methoxymethyl)azetidine
CID 58227482
4-ethyl-3-(methoxymethyl)cyclohexan-1-one
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3-(methoxymethyl)-1,4-thiazepane 1-oxide
CID 107511167
(2R)-2-tert-butylpiperidin-4-one
CID 86332731
(2S)-2-(methoxymethyl)-4-methyl-1,2,3,6-tetrahydropyridine
CID 174463776
2-(methoxymethyl)piperazine;dihydrochloride
CID 66941255
(2R)-2-(methoxymethyl)piperazine;dihydrochloride
CID 146013224
3-(methoxymethyl)-4,4-dimethylcyclohexan-1-one
CID 165496997
bis((2S)-2-(methoxymethyl)azetidine);oxalic acid
CID 91826002
(3S)-3-(methoxymethyl)-1,2,3,4-tetrahydroisoquinoline
CID 100971194
(2R)-2-[[(4S)-2,2-diphenyl-1,3-dioxolan-4-yl]methyl]piperidin-4-one
CID 25180442

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)piperidin-4-one?
The IUPAC name of 2-(methoxymethyl)piperidin-4-one (CID 82651344) is 2-(methoxymethyl)piperidin-4-one.
What is the SMILES notation for 2-(methoxymethyl)piperidin-4-one?
The canonical SMILES for 2-(methoxymethyl)piperidin-4-one is COCC1CC(=O)CCN1.
What is the InChIKey of 2-(methoxymethyl)piperidin-4-one?
The InChIKey is MEOIKYBUPNARAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-10-5-6-4-7(9)2-3-8-6/h6,8H,2-5H2,1H3.
What are the key properties of 2-(methoxymethyl)piperidin-4-one?
2-(methoxymethyl)piperidin-4-one has a molecular weight of 143.19 g/mol, XLogP of -0.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)piperidin-4-one is sourced from PubChem (CID 82651344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).