1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine

C21H46N4O2 — CID 144518882

IUPAC1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine
SMILESCN1CCNCC1.COCC1CCCN(C)C1.COCCN1CCCCC1
InChIInChI=1S/2C8H17NO.C5H12N2/c1-9-5-3-4-8(6-9)7-10-2;1-10-8-7-9-5-3-2-4-6-9;1-7-4-2-6-3-5-7/h8H,3-7H2,1-2H3;2-8H2,1H3;6H,2-5H2,1H3
InChIKeyCWGMGWHQLPISDU-UHFFFAOYSA-N
MW386.63 g/mol
LogP1.61
Rot. Bonds5

About 1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine

1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine (PubChem CID 144518882) has the molecular formula C21H46N4O2 and a molecular weight of 386.63 g/mol. Its IUPAC name is 1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine.

Molecular Properties

Compound Name1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine
PubChem CID144518882
Molecular FormulaC21H46N4O2
Molecular Weight386.63 g/mol
Exact Mass386.36
IUPAC Name1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine
SMILESCN1CCNCC1.COCC1CCCN(C)C1.COCCN1CCCCC1
InChIInChI=1S/2C8H17NO.C5H12N2/c1-9-5-3-4-8(6-9)7-10-2;1-10-8-7-9-5-3-2-4-6-9;1-7-4-2-6-3-5-7/h8H,3-7H2,1-2H3;2-8H2,1H3;6H,2-5H2,1H3
InChIKeyCWGMGWHQLPISDU-UHFFFAOYSA-N
XLogP1.61
TPSA40.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.63
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine?
The IUPAC name of 1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine (CID 144518882) is 1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine.
What is the SMILES notation for 1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine?
The canonical SMILES for 1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine is CN1CCNCC1.COCC1CCCN(C)C1.COCCN1CCCCC1.
What is the InChIKey of 1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine?
The InChIKey is CWGMGWHQLPISDU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H17NO.C5H12N2/c1-9-5-3-4-8(6-9)7-10-2;1-10-8-7-9-5-3-2-4-6-9;1-7-4-2-6-3-5-7/h8H,3-7H2,1-2H3;2-8H2,1H3;6H,2-5H2,1H3.
What are the key properties of 1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine?
1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine has a molecular weight of 386.63 g/mol, XLogP of 1.61, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)piperidine;3-(methoxymethyl)-1-methylpiperidine;1-methylpiperazine is sourced from PubChem (CID 144518882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).