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

C16H32N4 — CID 18770387

IUPAC1,4-bis(piperidin-4-ylmethyl)piperazine
SMILESC1CC(CN2CCN(CC3CCNCC3)CC2)CCN1
InChIInChI=1S/C16H32N4/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
InChIKeyCXPVURPCWVRDAG-UHFFFAOYSA-N
MW280.46 g/mol
LogP0.60
Rot. Bonds4

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

1,4-bis(piperidin-4-ylmethyl)piperazine (PubChem CID 18770387) has the molecular formula C16H32N4 and a molecular weight of 280.46 g/mol. Its IUPAC name is 1,4-bis(piperidin-4-ylmethyl)piperazine.

Molecular Properties

Compound Name1,4-bis(piperidin-4-ylmethyl)piperazine
PubChem CID18770387
Molecular FormulaC16H32N4
Molecular Weight280.46 g/mol
Exact Mass280.26
IUPAC Name1,4-bis(piperidin-4-ylmethyl)piperazine
SMILESC1CC(CN2CCN(CC3CCNCC3)CC2)CCN1
InChIInChI=1S/C16H32N4/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
InChIKeyCXPVURPCWVRDAG-UHFFFAOYSA-N
XLogP0.60
TPSA30.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride
CID 18770386
1-(piperidin-4-ylmethyl)-4-(2,2,2-trifluoroethyl)piperazine
CID 62967874
4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide
CID 119929956
1-(piperidin-4-ylmethyl)piperidin-4-one
CID 115020783
1-(1-methylpiperidin-4-yl)-4-(piperidin-4-ylmethyl)piperazine
CID 167265149
1-ethylsulfonyl-4-(piperidin-4-ylmethyl)piperazine;hydrochloride
CID 119930045
1-(4-ethylcyclohexyl)-4-(piperidin-4-ylmethyl)piperazine
CID 177134839
N-methyl-3-[4-(piperidin-4-ylmethyl)piperazin-1-yl]propan-1-amine
CID 177055250
N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine
CID 156720132
4-piperidin-1-yl-1-(piperidin-4-ylmethyl)piperidine
CID 61244264
4-cyclohexyloxy-1-(piperidin-4-ylmethyl)piperidine
CID 119931133
ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine
CID 144757867

Frequently Asked Questions

What is the IUPAC name of 1,4-bis(piperidin-4-ylmethyl)piperazine?
The IUPAC name of 1,4-bis(piperidin-4-ylmethyl)piperazine (CID 18770387) is 1,4-bis(piperidin-4-ylmethyl)piperazine.
What is the SMILES notation for 1,4-bis(piperidin-4-ylmethyl)piperazine?
The canonical SMILES for 1,4-bis(piperidin-4-ylmethyl)piperazine is C1CC(CN2CCN(CC3CCNCC3)CC2)CCN1.
What is the InChIKey of 1,4-bis(piperidin-4-ylmethyl)piperazine?
The InChIKey is CXPVURPCWVRDAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N4/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.
What are the key properties of 1,4-bis(piperidin-4-ylmethyl)piperazine?
1,4-bis(piperidin-4-ylmethyl)piperazine has a molecular weight of 280.46 g/mol, XLogP of 0.60, 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 is sourced from PubChem (CID 18770387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).