2-(3-methoxypiperidin-4-yl)-1-methylpiperazine

C11H23N3O — CID 91247100

IUPAC2-(3-methoxypiperidin-4-yl)-1-methylpiperazine
SMILESCOC1CNCCC1C1CNCCN1C
InChIInChI=1S/C11H23N3O/c1-14-6-5-13-7-10(14)9-3-4-12-8-11(9)15-2/h9-13H,3-8H2,1-2H3
InChIKeyAFJDBBGUINPDOO-UHFFFAOYSA-N
MW213.32 g/mol
LogP-0.49
Rot. Bonds2

About 2-(3-methoxypiperidin-4-yl)-1-methylpiperazine

2-(3-methoxypiperidin-4-yl)-1-methylpiperazine (PubChem CID 91247100) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-(3-methoxypiperidin-4-yl)-1-methylpiperazine.

Molecular Properties

Compound Name2-(3-methoxypiperidin-4-yl)-1-methylpiperazine
PubChem CID91247100
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name2-(3-methoxypiperidin-4-yl)-1-methylpiperazine
SMILESCOC1CNCCC1C1CNCCN1C
InChIInChI=1S/C11H23N3O/c1-14-6-5-13-7-10(14)9-3-4-12-8-11(9)15-2/h9-13H,3-8H2,1-2H3
InChIKeyAFJDBBGUINPDOO-UHFFFAOYSA-N
XLogP-0.49
TPSA36.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxypiperidin-4-yl)-1-methylpiperazine?
The IUPAC name of 2-(3-methoxypiperidin-4-yl)-1-methylpiperazine (CID 91247100) is 2-(3-methoxypiperidin-4-yl)-1-methylpiperazine.
What is the SMILES notation for 2-(3-methoxypiperidin-4-yl)-1-methylpiperazine?
The canonical SMILES for 2-(3-methoxypiperidin-4-yl)-1-methylpiperazine is COC1CNCCC1C1CNCCN1C.
What is the InChIKey of 2-(3-methoxypiperidin-4-yl)-1-methylpiperazine?
The InChIKey is AFJDBBGUINPDOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-14-6-5-13-7-10(14)9-3-4-12-8-11(9)15-2/h9-13H,3-8H2,1-2H3.
What are the key properties of 2-(3-methoxypiperidin-4-yl)-1-methylpiperazine?
2-(3-methoxypiperidin-4-yl)-1-methylpiperazine has a molecular weight of 213.32 g/mol, XLogP of -0.49, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxypiperidin-4-yl)-1-methylpiperazine is sourced from PubChem (CID 91247100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).