2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine

C15H25N3O — CID 104822316

IUPAC2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine
SMILESCOCC1CCN(C(CN)c2ccc(C)nc2)CC1
InChIInChI=1S/C15H25N3O/c1-12-3-4-14(10-17-12)15(9-16)18-7-5-13(6-8-18)11-19-2/h3-4,10,13,15H,5-9,11,16H2,1-2H3
InChIKeyXXTFMRPJHBLUNU-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.75
Rot. Bonds5

About 2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine

2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine (PubChem CID 104822316) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine
PubChem CID104822316
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine
SMILESCOCC1CCN(C(CN)c2ccc(C)nc2)CC1
InChIInChI=1S/C15H25N3O/c1-12-3-4-14(10-17-12)15(9-16)18-7-5-13(6-8-18)11-19-2/h3-4,10,13,15H,5-9,11,16H2,1-2H3
InChIKeyXXTFMRPJHBLUNU-UHFFFAOYSA-N
XLogP1.75
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine?
The IUPAC name of 2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine (CID 104822316) is 2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine?
The canonical SMILES for 2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine is COCC1CCN(C(CN)c2ccc(C)nc2)CC1.
What is the InChIKey of 2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine?
The InChIKey is XXTFMRPJHBLUNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-12-3-4-14(10-17-12)15(9-16)18-7-5-13(6-8-18)11-19-2/h3-4,10,13,15H,5-9,11,16H2,1-2H3.
What are the key properties of 2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine?
2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine has a molecular weight of 263.38 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methoxymethyl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 104822316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).