2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine

C16H19N3 — CID 16667834

IUPAC2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine
SMILESc1ccc(CN2CCC(c3ccncc3)CC2)nc1
InChIInChI=1S/C16H19N3/c1-2-8-18-16(3-1)13-19-11-6-15(7-12-19)14-4-9-17-10-5-14/h1-5,8-10,15H,6-7,11-13H2
InChIKeyHZCBDOOHVFOWDI-UHFFFAOYSA-N
MW253.35 g/mol
LogP2.86
Rot. Bonds3

About 2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine

2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine (PubChem CID 16667834) has the molecular formula C16H19N3 and a molecular weight of 253.35 g/mol. Its IUPAC name is 2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine.

Molecular Properties

Compound Name2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine
PubChem CID16667834
Molecular FormulaC16H19N3
Molecular Weight253.35 g/mol
Exact Mass253.16
IUPAC Name2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine
SMILESc1ccc(CN2CCC(c3ccncc3)CC2)nc1
InChIInChI=1S/C16H19N3/c1-2-8-18-16(3-1)13-19-11-6-15(7-12-19)14-4-9-17-10-5-14/h1-5,8-10,15H,6-7,11-13H2
InChIKeyHZCBDOOHVFOWDI-UHFFFAOYSA-N
XLogP2.86
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-bromopiperidin-1-yl)methyl]pyridine
CID 80680400
4-[1-[(4-pyridin-4-ylpiperidin-1-yl)methyl]piperidin-4-yl]pyridine
CID 59705532
2-[[4-(trifluoromethyl)piperidin-1-yl]methyl]pyridine
CID 131703770
CID 59694740
CID 59694740
4-(1-benzylpyrrolidin-3-yl)pyridine
CID 11085844
2-[1-(pyridin-2-ylmethyl)piperidin-4-yl]-1H-benzimidazole
CID 16798070
N-(cyclopropylmethyl)-1-(pyridin-2-ylmethyl)piperidin-4-amine
CID 78921206
N'-[1-(pyridin-2-ylmethyl)piperidin-4-yl]ethane-1,2-diamine
CID 142667116
1-cycloheptyl-4-(pyridin-2-ylmethyl)piperazine
CID 787097
4-methyl-2-[(3R)-1-(pyridin-2-ylmethyl)pyrrolidin-3-yl]pyrimidine
CID 124999909
phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol
CID 110906747
6-pyridin-4-yl-2-[1-(pyridin-2-ylmethyl)pyrrolidin-3-yl]-[1,2,4]triazolo[1,5-a]pyridine
CID 131673441

Frequently Asked Questions

What is the IUPAC name of 2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine?
The IUPAC name of 2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine (CID 16667834) is 2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine.
What is the SMILES notation for 2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine?
The canonical SMILES for 2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine is c1ccc(CN2CCC(c3ccncc3)CC2)nc1.
What is the InChIKey of 2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine?
The InChIKey is HZCBDOOHVFOWDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3/c1-2-8-18-16(3-1)13-19-11-6-15(7-12-19)14-4-9-17-10-5-14/h1-5,8-10,15H,6-7,11-13H2.
What are the key properties of 2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine?
2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine has a molecular weight of 253.35 g/mol, XLogP of 2.86, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine is sourced from PubChem (CID 16667834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).