(4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone

C13H24N2O2 — CID 43373218

IUPAC(4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone
SMILESCOC1CCN(C(=O)C2CCC(C)NC2)CC1
InChIInChI=1S/C13H24N2O2/c1-10-3-4-11(9-14-10)13(16)15-7-5-12(17-2)6-8-15/h10-12,14H,3-9H2,1-2H3
InChIKeyQBNRJRDZXRRXRZ-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.01
Rot. Bonds2

About (4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone

(4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone (PubChem CID 43373218) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is (4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone.

Molecular Properties

Compound Name(4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone
PubChem CID43373218
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name(4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone
SMILESCOC1CCN(C(=O)C2CCC(C)NC2)CC1
InChIInChI=1S/C13H24N2O2/c1-10-3-4-11(9-14-10)13(16)15-7-5-12(17-2)6-8-15/h10-12,14H,3-9H2,1-2H3
InChIKeyQBNRJRDZXRRXRZ-UHFFFAOYSA-N
XLogP1.01
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone?
The IUPAC name of (4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone (CID 43373218) is (4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone.
What is the SMILES notation for (4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone?
The canonical SMILES for (4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone is COC1CCN(C(=O)C2CCC(C)NC2)CC1.
What is the InChIKey of (4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone?
The InChIKey is QBNRJRDZXRRXRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-10-3-4-11(9-14-10)13(16)15-7-5-12(17-2)6-8-15/h10-12,14H,3-9H2,1-2H3.
What are the key properties of (4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone?
(4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone has a molecular weight of 240.35 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxypiperidin-1-yl)-(6-methylpiperidin-3-yl)methanone is sourced from PubChem (CID 43373218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).