1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride

C16H36Cl4N4 — CID 18770386

IUPAC1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride
SMILESC1CC(CN2CCN(CC3CCNCC3)CC2)CCN1.Cl.Cl.Cl.Cl
InChIInChI=1S/C16H32N4.4ClH/c1-5-17-6-2-15(1)13-19-9-11-20(12-10-19)14-16-3-7-18-8-4-16;;;;/h15-18H,1-14H2;4*1H
InChIKeyGMMURQJRDFFQDW-UHFFFAOYSA-N
MW426.30 g/mol
LogP2.29
Rot. Bonds4

About 1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride

1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride (PubChem CID 18770386) has the molecular formula C16H36Cl4N4 and a molecular weight of 426.30 g/mol. Its IUPAC name is 1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride.

Molecular Properties

Compound Name1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride
PubChem CID18770386
Molecular FormulaC16H36Cl4N4
Molecular Weight426.30 g/mol
Exact Mass424.17
IUPAC Name1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride
SMILESC1CC(CN2CCN(CC3CCNCC3)CC2)CCN1.Cl.Cl.Cl.Cl
InChIInChI=1S/C16H32N4.4ClH/c1-5-17-6-2-15(1)13-19-9-11-20(12-10-19)14-16-3-7-18-8-4-16;;;;/h15-18H,1-14H2;4*1H
InChIKeyGMMURQJRDFFQDW-UHFFFAOYSA-N
XLogP2.29
TPSA30.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.30
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1,4-bis(piperidin-4-ylmethyl)piperazine
CID 18770387
1-(piperidin-4-ylmethyl)-4-(2,2,2-trifluoroethyl)piperazine
CID 62967874
1-ethylsulfonyl-4-(piperidin-4-ylmethyl)piperazine;hydrochloride
CID 119930045
4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide
CID 119929956
1-(piperidin-4-ylmethyl)piperidin-4-one
CID 115020783
4-methyl-1-(piperidin-4-ylmethyl)azepane;hydrochloride
CID 119930987
1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]ethanol;hydrochloride
CID 119931316
1-(1-methylpiperidin-4-yl)-4-(piperidin-4-ylmethyl)piperazine
CID 167265149
4-[(3-cyclopropylpyrrolidin-1-yl)methyl]piperidine;hydrochloride
CID 120849683
1-(4-chlorophenyl)-4-(piperidin-4-ylmethyl)piperazine;dihydrochloride
CID 119932561
1-(4-ethylcyclohexyl)-4-(piperidin-4-ylmethyl)piperazine
CID 177134839
4-(3-methylbutyl)-1-(piperidin-4-ylmethyl)piperidine;hydrochloride
CID 119932466

Frequently Asked Questions

What is the IUPAC name of 1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride?
The IUPAC name of 1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride (CID 18770386) is 1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride.
What is the SMILES notation for 1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride?
The canonical SMILES for 1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride is C1CC(CN2CCN(CC3CCNCC3)CC2)CCN1.Cl.Cl.Cl.Cl.
What is the InChIKey of 1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride?
The InChIKey is GMMURQJRDFFQDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N4.4ClH/c1-5-17-6-2-15(1)13-19-9-11-20(12-10-19)14-16-3-7-18-8-4-16;;;;/h15-18H,1-14H2;4*1H.
What are the key properties of 1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride?
1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride has a molecular weight of 426.30 g/mol, XLogP of 2.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride is sourced from PubChem (CID 18770386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).