4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine

C16H25N3 — CID 18328928

IUPAC4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine
SMILESc1cc(C2CCN(CC3CCNCC3)CC2)ccn1
InChIInChI=1S/C16H25N3/c1-7-17-8-2-14(1)13-19-11-5-16(6-12-19)15-3-9-18-10-4-15/h3-4,9-10,14,16-17H,1-2,5-8,11-13H2
InChIKeyHMRHQGZFXVGVKA-UHFFFAOYSA-N
MW259.40 g/mol
LogP2.26
Rot. Bonds3

About 4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine

4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine (PubChem CID 18328928) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is 4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine.

Molecular Properties

Compound Name4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine
PubChem CID18328928
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC Name4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine
SMILESc1cc(C2CCN(CC3CCNCC3)CC2)ccn1
InChIInChI=1S/C16H25N3/c1-7-17-8-2-14(1)13-19-11-5-16(6-12-19)15-3-9-18-10-4-15/h3-4,9-10,14,16-17H,1-2,5-8,11-13H2
InChIKeyHMRHQGZFXVGVKA-UHFFFAOYSA-N
XLogP2.26
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-phenyl-1-(piperidin-4-ylmethyl)azepane;hydrochloride
CID 119931344
4-[1-[(4-pyridin-4-ylpiperidin-1-yl)methyl]piperidin-4-yl]pyridine
CID 59705532
1-(piperidin-4-ylmethyl)-4-(1H-pyrazol-4-yl)piperidine
CID 120847965
1,4-bis(piperidin-4-ylmethyl)piperazine
CID 18770387
4-[1-[[1-(4-bromophenyl)sulfonylpiperidin-4-yl]methyl]piperidin-4-yl]pyridine
CID 18328899
4-(2,6-difluorophenyl)-1-(piperidin-4-ylmethyl)piperidine
CID 120851603
3-[[1-(piperidin-4-ylmethyl)piperidin-4-yl]methyl]pyridine;hydrochloride
CID 120849136
1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride
CID 18770386
4-phenyl-1-(2-piperidin-4-ylethyl)piperidine
CID 68767972
4-[[3-(3-fluorophenyl)pyrrolidin-1-yl]methyl]piperidine;hydrochloride
CID 119931475
1-(piperidin-4-ylmethyl)-4-(1,2,4-triazol-1-ylmethyl)piperidine
CID 120851131
2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine
CID 16667834

Frequently Asked Questions

What is the IUPAC name of 4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine?
The IUPAC name of 4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine (CID 18328928) is 4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine.
What is the SMILES notation for 4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine?
The canonical SMILES for 4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine is c1cc(C2CCN(CC3CCNCC3)CC2)ccn1.
What is the InChIKey of 4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine?
The InChIKey is HMRHQGZFXVGVKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-7-17-8-2-14(1)13-19-11-5-16(6-12-19)15-3-9-18-10-4-15/h3-4,9-10,14,16-17H,1-2,5-8,11-13H2.
What are the key properties of 4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine?
4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine has a molecular weight of 259.40 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine is sourced from PubChem (CID 18328928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).