(3S)-3-(methoxymethyl)-1-methylpiperidine

C8H17NO — CID 58134332

IUPAC(3S)-3-(methoxymethyl)-1-methylpiperidine
SMILESCOC[C@H]1CCCN(C)C1
InChIInChI=1S/C8H17NO/c1-9-5-3-4-8(6-9)7-10-2/h8H,3-7H2,1-2H3/t8-/m0/s1
InChIKeyQCPIRWAFDXWUNY-QMMMGPOBSA-N
MW143.23 g/mol
LogP0.97
Rot. Bonds2

About (3S)-3-(methoxymethyl)-1-methylpiperidine

(3S)-3-(methoxymethyl)-1-methylpiperidine (PubChem CID 58134332) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (3S)-3-(methoxymethyl)-1-methylpiperidine.

Molecular Properties

Compound Name(3S)-3-(methoxymethyl)-1-methylpiperidine
PubChem CID58134332
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(3S)-3-(methoxymethyl)-1-methylpiperidine
SMILESCOC[C@H]1CCCN(C)C1
InChIInChI=1S/C8H17NO/c1-9-5-3-4-8(6-9)7-10-2/h8H,3-7H2,1-2H3/t8-/m0/s1
InChIKeyQCPIRWAFDXWUNY-QMMMGPOBSA-N
XLogP0.97
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(ethenoxymethyl)-1-methylpiperidine
CID 122664385
1-methyl-3-(propoxymethyl)piperidine
CID 148501632
N-(methoxymethyl)-N-methyl-1-(1-methylpiperidin-3-yl)methanamine
CID 115258790
(3S)-3-(methoxymethyl)-1-propan-2-ylpiperidine
CID 167395488
ethane;3-ethyl-1-methylpiperidine
CID 142833851
(3S)-3-(chloromethyl)-1-methylpiperidine
CID 1268113
1-(3-bromopropyl)-3-(methoxymethyl)piperidine
CID 106588360
3-(methoxymethyl)-1-methyl-6-propylazocane
CID 70899502
ethane;(1-methylpiperidin-3-yl)methanol
CID 142013659
methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine
CID 172576332
methyl (1-methylpiperidin-3-yl)methanesulfonate
CID 175223717
6-[3-(methoxymethyl)piperidin-1-yl]hexan-1-amine
CID 106587405

Frequently Asked Questions

What is the IUPAC name of (3S)-3-(methoxymethyl)-1-methylpiperidine?
The IUPAC name of (3S)-3-(methoxymethyl)-1-methylpiperidine (CID 58134332) is (3S)-3-(methoxymethyl)-1-methylpiperidine.
What is the SMILES notation for (3S)-3-(methoxymethyl)-1-methylpiperidine?
The canonical SMILES for (3S)-3-(methoxymethyl)-1-methylpiperidine is COC[C@H]1CCCN(C)C1.
What is the InChIKey of (3S)-3-(methoxymethyl)-1-methylpiperidine?
The InChIKey is QCPIRWAFDXWUNY-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H17NO/c1-9-5-3-4-8(6-9)7-10-2/h8H,3-7H2,1-2H3/t8-/m0/s1.
What are the key properties of (3S)-3-(methoxymethyl)-1-methylpiperidine?
(3S)-3-(methoxymethyl)-1-methylpiperidine has a molecular weight of 143.23 g/mol, XLogP of 0.97, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-(methoxymethyl)-1-methylpiperidine is sourced from PubChem (CID 58134332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).