3-methyl-4-piperidin-4-ylpyridine

C11H16N2 — CID 64985067

IUPAC3-methyl-4-piperidin-4-ylpyridine
SMILESCc1cnccc1C1CCNCC1
InChIInChI=1S/C11H16N2/c1-9-8-13-7-4-11(9)10-2-5-12-6-3-10/h4,7-8,10,12H,2-3,5-6H2,1H3
InChIKeyDZTYDIQRLJTRCW-UHFFFAOYSA-N
MW176.26 g/mol
LogP1.86
Rot. Bonds1

About 3-methyl-4-piperidin-4-ylpyridine

3-methyl-4-piperidin-4-ylpyridine (PubChem CID 64985067) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 3-methyl-4-piperidin-4-ylpyridine.

Molecular Properties

Compound Name3-methyl-4-piperidin-4-ylpyridine
PubChem CID64985067
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name3-methyl-4-piperidin-4-ylpyridine
SMILESCc1cnccc1C1CCNCC1
InChIInChI=1S/C11H16N2/c1-9-8-13-7-4-11(9)10-2-5-12-6-3-10/h4,7-8,10,12H,2-3,5-6H2,1H3
InChIKeyDZTYDIQRLJTRCW-UHFFFAOYSA-N
XLogP1.86
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-piperidin-4-ylpyridine?
The IUPAC name of 3-methyl-4-piperidin-4-ylpyridine (CID 64985067) is 3-methyl-4-piperidin-4-ylpyridine.
What is the SMILES notation for 3-methyl-4-piperidin-4-ylpyridine?
The canonical SMILES for 3-methyl-4-piperidin-4-ylpyridine is Cc1cnccc1C1CCNCC1.
What is the InChIKey of 3-methyl-4-piperidin-4-ylpyridine?
The InChIKey is DZTYDIQRLJTRCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-9-8-13-7-4-11(9)10-2-5-12-6-3-10/h4,7-8,10,12H,2-3,5-6H2,1H3.
What are the key properties of 3-methyl-4-piperidin-4-ylpyridine?
3-methyl-4-piperidin-4-ylpyridine has a molecular weight of 176.26 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-piperidin-4-ylpyridine is sourced from PubChem (CID 64985067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).