1-[di(piperidin-1-yl)methyl]piperidine

C16H31N3 — CID 12601920

IUPAC1-[di(piperidin-1-yl)methyl]piperidine
SMILESC1CCN(C(N2CCCCC2)N2CCCCC2)CC1
InChIInChI=1S/C16H31N3/c1-4-10-17(11-5-1)16(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h16H,1-15H2
InChIKeyLSKNNOZGCOKKLX-UHFFFAOYSA-N
MW265.44 g/mol
LogP2.73
Rot. Bonds3

About 1-[di(piperidin-1-yl)methyl]piperidine

1-[di(piperidin-1-yl)methyl]piperidine (PubChem CID 12601920) has the molecular formula C16H31N3 and a molecular weight of 265.44 g/mol. Its IUPAC name is 1-[di(piperidin-1-yl)methyl]piperidine.

Molecular Properties

Compound Name1-[di(piperidin-1-yl)methyl]piperidine
PubChem CID12601920
Molecular FormulaC16H31N3
Molecular Weight265.44 g/mol
Exact Mass265.25
IUPAC Name1-[di(piperidin-1-yl)methyl]piperidine
SMILESC1CCN(C(N2CCCCC2)N2CCCCC2)CC1
InChIInChI=1S/C16H31N3/c1-4-10-17(11-5-1)16(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h16H,1-15H2
InChIKeyLSKNNOZGCOKKLX-UHFFFAOYSA-N
XLogP2.73
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[di(piperidin-1-yl)methyl]piperidine?
The IUPAC name of 1-[di(piperidin-1-yl)methyl]piperidine (CID 12601920) is 1-[di(piperidin-1-yl)methyl]piperidine.
What is the SMILES notation for 1-[di(piperidin-1-yl)methyl]piperidine?
The canonical SMILES for 1-[di(piperidin-1-yl)methyl]piperidine is C1CCN(C(N2CCCCC2)N2CCCCC2)CC1.
What is the InChIKey of 1-[di(piperidin-1-yl)methyl]piperidine?
The InChIKey is LSKNNOZGCOKKLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3/c1-4-10-17(11-5-1)16(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h16H,1-15H2.
What are the key properties of 1-[di(piperidin-1-yl)methyl]piperidine?
1-[di(piperidin-1-yl)methyl]piperidine has a molecular weight of 265.44 g/mol, XLogP of 2.73, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[di(piperidin-1-yl)methyl]piperidine is sourced from PubChem (CID 12601920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).