3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine

C11H24N2O2 — CID 62534739

IUPAC3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine
SMILESCOCC(C)(CN)N1CCC(OC)CC1
InChIInChI=1S/C11H24N2O2/c1-11(8-12,9-14-2)13-6-4-10(15-3)5-7-13/h10H,4-9,12H2,1-3H3
InChIKeyXSMUJOQUEZMUDU-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.46
Rot. Bonds5

About 3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine

3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine (PubChem CID 62534739) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine
PubChem CID62534739
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine
SMILESCOCC(C)(CN)N1CCC(OC)CC1
InChIInChI=1S/C11H24N2O2/c1-11(8-12,9-14-2)13-6-4-10(15-3)5-7-13/h10H,4-9,12H2,1-3H3
InChIKeyXSMUJOQUEZMUDU-UHFFFAOYSA-N
XLogP0.46
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine?
The IUPAC name of 3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine (CID 62534739) is 3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine.
What is the SMILES notation for 3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine?
The canonical SMILES for 3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine is COCC(C)(CN)N1CCC(OC)CC1.
What is the InChIKey of 3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine?
The InChIKey is XSMUJOQUEZMUDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-11(8-12,9-14-2)13-6-4-10(15-3)5-7-13/h10H,4-9,12H2,1-3H3.
What are the key properties of 3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine?
3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine has a molecular weight of 216.32 g/mol, XLogP of 0.46, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-(4-methoxypiperidin-1-yl)-2-methylpropan-1-amine is sourced from PubChem (CID 62534739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).