(1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone

C15H28N2O2 — CID 167010736

IUPAC(1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone
SMILESCCN1CCC(C(=O)N2CCC(COC)CC2)CC1
InChIInChI=1S/C15H28N2O2/c1-3-16-8-6-14(7-9-16)15(18)17-10-4-13(5-11-17)12-19-2/h13-14H,3-12H2,1-2H3
InChIKeyMZPLVBLAXCREPC-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.60
Rot. Bonds4

About (1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone

(1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone (PubChem CID 167010736) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is (1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone
PubChem CID167010736
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name(1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone
SMILESCCN1CCC(C(=O)N2CCC(COC)CC2)CC1
InChIInChI=1S/C15H28N2O2/c1-3-16-8-6-14(7-9-16)15(18)17-10-4-13(5-11-17)12-19-2/h13-14H,3-12H2,1-2H3
InChIKeyMZPLVBLAXCREPC-UHFFFAOYSA-N
XLogP1.60
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone?
The IUPAC name of (1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone (CID 167010736) is (1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone.
What is the SMILES notation for (1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone?
The canonical SMILES for (1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone is CCN1CCC(C(=O)N2CCC(COC)CC2)CC1.
What is the InChIKey of (1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone?
The InChIKey is MZPLVBLAXCREPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-3-16-8-6-14(7-9-16)15(18)17-10-4-13(5-11-17)12-19-2/h13-14H,3-12H2,1-2H3.
What are the key properties of (1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone?
(1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone has a molecular weight of 268.40 g/mol, XLogP of 1.60, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylpiperidin-4-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 167010736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).