1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride

C10H24Cl3N3 — CID 71742137

IUPAC1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride
SMILESCN1CCC(N2CCNCC2)CC1.Cl.Cl.Cl
InChIInChI=1S/C10H21N3.3ClH/c1-12-6-2-10(3-7-12)13-8-4-11-5-9-13;;;/h10-11H,2-9H2,1H3;3*1H
InChIKeyNDZOOUAUKYVQEO-UHFFFAOYSA-N
MW292.68 g/mol
LogP1.25
Rot. Bonds1

About 1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride

1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride (PubChem CID 71742137) has the molecular formula C10H24Cl3N3 and a molecular weight of 292.68 g/mol. Its IUPAC name is 1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride.

Molecular Properties

Compound Name1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride
PubChem CID71742137
Molecular FormulaC10H24Cl3N3
Molecular Weight292.68 g/mol
Exact Mass291.10
IUPAC Name1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride
SMILESCN1CCC(N2CCNCC2)CC1.Cl.Cl.Cl
InChIInChI=1S/C10H21N3.3ClH/c1-12-6-2-10(3-7-12)13-8-4-11-5-9-13;;;/h10-11H,2-9H2,1H3;3*1H
InChIKeyNDZOOUAUKYVQEO-UHFFFAOYSA-N
XLogP1.25
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.68
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride?
The IUPAC name of 1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride (CID 71742137) is 1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride.
What is the SMILES notation for 1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride?
The canonical SMILES for 1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride is CN1CCC(N2CCNCC2)CC1.Cl.Cl.Cl.
What is the InChIKey of 1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride?
The InChIKey is NDZOOUAUKYVQEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3.3ClH/c1-12-6-2-10(3-7-12)13-8-4-11-5-9-13;;;/h10-11H,2-9H2,1H3;3*1H.
What are the key properties of 1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride?
1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride has a molecular weight of 292.68 g/mol, XLogP of 1.25, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpiperidin-4-yl)piperazine;trihydrochloride is sourced from PubChem (CID 71742137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).