5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine

C13H20N2O — CID 164927032

IUPAC5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine
SMILESCOCC1CCCN(c2ccc(C)nc2)C1
InChIInChI=1S/C13H20N2O/c1-11-5-6-13(8-14-11)15-7-3-4-12(9-15)10-16-2/h5-6,8,12H,3-4,7,9-10H2,1-2H3
InChIKeyOPNNDZJGNPEAOM-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.25
Rot. Bonds3

About 5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine

5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine (PubChem CID 164927032) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine.

Molecular Properties

Compound Name5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine
PubChem CID164927032
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine
SMILESCOCC1CCCN(c2ccc(C)nc2)C1
InChIInChI=1S/C13H20N2O/c1-11-5-6-13(8-14-11)15-7-3-4-12(9-15)10-16-2/h5-6,8,12H,3-4,7,9-10H2,1-2H3
InChIKeyOPNNDZJGNPEAOM-UHFFFAOYSA-N
XLogP2.25
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine?
The IUPAC name of 5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine (CID 164927032) is 5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine.
What is the SMILES notation for 5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine?
The canonical SMILES for 5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine is COCC1CCCN(c2ccc(C)nc2)C1.
What is the InChIKey of 5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine?
The InChIKey is OPNNDZJGNPEAOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-11-5-6-13(8-14-11)15-7-3-4-12(9-15)10-16-2/h5-6,8,12H,3-4,7,9-10H2,1-2H3.
What are the key properties of 5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine?
5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine has a molecular weight of 220.32 g/mol, XLogP of 2.25, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine is sourced from PubChem (CID 164927032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).