1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride

C14H30Cl2N2O — CID 129318593

IUPAC1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride
SMILESC1CCN(CCOCCN2CCCCC2)CC1.Cl.Cl
InChIInChI=1S/C14H28N2O.2ClH/c1-3-7-15(8-4-1)11-13-17-14-12-16-9-5-2-6-10-16;;/h1-14H2;2*1H
InChIKeyWSGXOAYUQNXYBL-UHFFFAOYSA-N
MW313.31 g/mol
LogP2.82
Rot. Bonds6

About 1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride

1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride (PubChem CID 129318593) has the molecular formula C14H30Cl2N2O and a molecular weight of 313.31 g/mol. Its IUPAC name is 1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride.

Molecular Properties

Compound Name1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride
PubChem CID129318593
Molecular FormulaC14H30Cl2N2O
Molecular Weight313.31 g/mol
Exact Mass312.17
IUPAC Name1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride
SMILESC1CCN(CCOCCN2CCCCC2)CC1.Cl.Cl
InChIInChI=1S/C14H28N2O.2ClH/c1-3-7-15(8-4-1)11-13-17-14-12-16-9-5-2-6-10-16;;/h1-14H2;2*1H
InChIKeyWSGXOAYUQNXYBL-UHFFFAOYSA-N
XLogP2.82
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.31
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride?
The IUPAC name of 1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride (CID 129318593) is 1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride.
What is the SMILES notation for 1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride?
The canonical SMILES for 1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride is C1CCN(CCOCCN2CCCCC2)CC1.Cl.Cl.
What is the InChIKey of 1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride?
The InChIKey is WSGXOAYUQNXYBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O.2ClH/c1-3-7-15(8-4-1)11-13-17-14-12-16-9-5-2-6-10-16;;/h1-14H2;2*1H.
What are the key properties of 1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride?
1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride has a molecular weight of 313.31 g/mol, XLogP of 2.82, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-piperidin-1-ylethoxy)ethyl]piperidine;dihydrochloride is sourced from PubChem (CID 129318593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).