(2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine

C12H26N2O — CID 166013273

IUPAC(2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine
SMILESCOC1CCN([C@H](C)CNC(C)C)CC1
InChIInChI=1S/C12H26N2O/c1-10(2)13-9-11(3)14-7-5-12(15-4)6-8-14/h10-13H,5-9H2,1-4H3/t11-/m1/s1
InChIKeyHUDCEWACYINLGY-LLVKDONJSA-N
MW214.35 g/mol
LogP1.48
Rot. Bonds5

About (2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine

(2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine (PubChem CID 166013273) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is (2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound Name(2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine
PubChem CID166013273
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name(2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine
SMILESCOC1CCN([C@H](C)CNC(C)C)CC1
InChIInChI=1S/C12H26N2O/c1-10(2)13-9-11(3)14-7-5-12(15-4)6-8-14/h10-13H,5-9H2,1-4H3/t11-/m1/s1
InChIKeyHUDCEWACYINLGY-LLVKDONJSA-N
XLogP1.48
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine?
The IUPAC name of (2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine (CID 166013273) is (2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for (2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine?
The canonical SMILES for (2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine is COC1CCN([C@H](C)CNC(C)C)CC1.
What is the InChIKey of (2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine?
The InChIKey is HUDCEWACYINLGY-LLVKDONJSA-N. The full InChI is InChI=1S/C12H26N2O/c1-10(2)13-9-11(3)14-7-5-12(15-4)6-8-14/h10-13H,5-9H2,1-4H3/t11-/m1/s1.
What are the key properties of (2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine?
(2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-methoxypiperidin-1-yl)-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 166013273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).