4-methyl-1-(piperidin-3-ylmethyl)piperidine

C12H24N2 — CID 16767828

IUPAC4-methyl-1-(piperidin-3-ylmethyl)piperidine
SMILESCC1CCN(CC2CCCNC2)CC1
InChIInChI=1S/C12H24N2/c1-11-4-7-14(8-5-11)10-12-3-2-6-13-9-12/h11-13H,2-10H2,1H3
InChIKeyXOZOEASNBZIJBW-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.72
Rot. Bonds2

About 4-methyl-1-(piperidin-3-ylmethyl)piperidine

4-methyl-1-(piperidin-3-ylmethyl)piperidine (PubChem CID 16767828) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 4-methyl-1-(piperidin-3-ylmethyl)piperidine.

Molecular Properties

Compound Name4-methyl-1-(piperidin-3-ylmethyl)piperidine
PubChem CID16767828
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name4-methyl-1-(piperidin-3-ylmethyl)piperidine
SMILESCC1CCN(CC2CCCNC2)CC1
InChIInChI=1S/C12H24N2/c1-11-4-7-14(8-5-11)10-12-3-2-6-13-9-12/h11-13H,2-10H2,1H3
InChIKeyXOZOEASNBZIJBW-UHFFFAOYSA-N
XLogP1.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(piperidin-3-ylmethyl)piperidine?
The IUPAC name of 4-methyl-1-(piperidin-3-ylmethyl)piperidine (CID 16767828) is 4-methyl-1-(piperidin-3-ylmethyl)piperidine.
What is the SMILES notation for 4-methyl-1-(piperidin-3-ylmethyl)piperidine?
The canonical SMILES for 4-methyl-1-(piperidin-3-ylmethyl)piperidine is CC1CCN(CC2CCCNC2)CC1.
What is the InChIKey of 4-methyl-1-(piperidin-3-ylmethyl)piperidine?
The InChIKey is XOZOEASNBZIJBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-11-4-7-14(8-5-11)10-12-3-2-6-13-9-12/h11-13H,2-10H2,1H3.
What are the key properties of 4-methyl-1-(piperidin-3-ylmethyl)piperidine?
4-methyl-1-(piperidin-3-ylmethyl)piperidine has a molecular weight of 196.34 g/mol, XLogP of 1.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(piperidin-3-ylmethyl)piperidine is sourced from PubChem (CID 16767828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).