1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine

C22H44N2O2 — CID 91435246

IUPAC1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine
SMILESCCC(CCCC1CCCN(CCOC)C1)C1CCN(CCOC)CC1
InChIInChI=1S/C22H44N2O2/c1-4-21(22-10-13-23(14-11-22)15-17-25-2)9-5-7-20-8-6-12-24(19-20)16-18-26-3/h20-22H,4-19H2,1-3H3
InChIKeyIZSNCDFIBRJUPZ-UHFFFAOYSA-N
MW368.61 g/mol
LogP3.90
Rot. Bonds12

About 1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine

1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine (PubChem CID 91435246) has the molecular formula C22H44N2O2 and a molecular weight of 368.61 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine
PubChem CID91435246
Molecular FormulaC22H44N2O2
Molecular Weight368.61 g/mol
Exact Mass368.34
IUPAC Name1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine
SMILESCCC(CCCC1CCCN(CCOC)C1)C1CCN(CCOC)CC1
InChIInChI=1S/C22H44N2O2/c1-4-21(22-10-13-23(14-11-22)15-17-25-2)9-5-7-20-8-6-12-24(19-20)16-18-26-3/h20-22H,4-19H2,1-3H3
InChIKeyIZSNCDFIBRJUPZ-UHFFFAOYSA-N
XLogP3.90
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.61
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine?
The IUPAC name of 1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine (CID 91435246) is 1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine.
What is the SMILES notation for 1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine?
The canonical SMILES for 1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine is CCC(CCCC1CCCN(CCOC)C1)C1CCN(CCOC)CC1.
What is the InChIKey of 1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine?
The InChIKey is IZSNCDFIBRJUPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H44N2O2/c1-4-21(22-10-13-23(14-11-22)15-17-25-2)9-5-7-20-8-6-12-24(19-20)16-18-26-3/h20-22H,4-19H2,1-3H3.
What are the key properties of 1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine?
1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine has a molecular weight of 368.61 g/mol, XLogP of 3.90, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-3-[4-[1-(2-methoxyethyl)piperidin-4-yl]hexyl]piperidine is sourced from PubChem (CID 91435246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).