2,5-bis(piperidin-1-ylmethyl)piperidine

C17H33N3 — CID 13158784

IUPAC2,5-bis(piperidin-1-ylmethyl)piperidine
SMILESC1CCN(CC2CCC(CN3CCCCC3)NC2)CC1
InChIInChI=1S/C17H33N3/c1-3-9-19(10-4-1)14-16-7-8-17(18-13-16)15-20-11-5-2-6-12-20/h16-18H,1-15H2
InChIKeyRWHCWLSAXCVQPK-UHFFFAOYSA-N
MW279.47 g/mol
LogP2.33
Rot. Bonds4

About 2,5-bis(piperidin-1-ylmethyl)piperidine

2,5-bis(piperidin-1-ylmethyl)piperidine (PubChem CID 13158784) has the molecular formula C17H33N3 and a molecular weight of 279.47 g/mol. Its IUPAC name is 2,5-bis(piperidin-1-ylmethyl)piperidine.

Molecular Properties

Compound Name2,5-bis(piperidin-1-ylmethyl)piperidine
PubChem CID13158784
Molecular FormulaC17H33N3
Molecular Weight279.47 g/mol
Exact Mass279.27
IUPAC Name2,5-bis(piperidin-1-ylmethyl)piperidine
SMILESC1CCN(CC2CCC(CN3CCCCC3)NC2)CC1
InChIInChI=1S/C17H33N3/c1-3-9-19(10-4-1)14-16-7-8-17(18-13-16)15-20-11-5-2-6-12-20/h16-18H,1-15H2
InChIKeyRWHCWLSAXCVQPK-UHFFFAOYSA-N
XLogP2.33
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.47
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,5-bis(piperidin-1-ylmethyl)piperidine?
The IUPAC name of 2,5-bis(piperidin-1-ylmethyl)piperidine (CID 13158784) is 2,5-bis(piperidin-1-ylmethyl)piperidine.
What is the SMILES notation for 2,5-bis(piperidin-1-ylmethyl)piperidine?
The canonical SMILES for 2,5-bis(piperidin-1-ylmethyl)piperidine is C1CCN(CC2CCC(CN3CCCCC3)NC2)CC1.
What is the InChIKey of 2,5-bis(piperidin-1-ylmethyl)piperidine?
The InChIKey is RWHCWLSAXCVQPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3/c1-3-9-19(10-4-1)14-16-7-8-17(18-13-16)15-20-11-5-2-6-12-20/h16-18H,1-15H2.
What are the key properties of 2,5-bis(piperidin-1-ylmethyl)piperidine?
2,5-bis(piperidin-1-ylmethyl)piperidine has a molecular weight of 279.47 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(piperidin-1-ylmethyl)piperidine is sourced from PubChem (CID 13158784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).