4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine

C16H19N3 — CID 110258581

IUPAC4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
SMILESc1cc(CN2CCCC(c3ccncc3)C2)ccn1
InChIInChI=1S/C16H19N3/c1-2-16(15-5-9-18-10-6-15)13-19(11-1)12-14-3-7-17-8-4-14/h3-10,16H,1-2,11-13H2
InChIKeyYIPRVTYOJGXJTI-UHFFFAOYSA-N
MW253.35 g/mol
LogP2.86
Rot. Bonds3

About 4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine

4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine (PubChem CID 110258581) has the molecular formula C16H19N3 and a molecular weight of 253.35 g/mol. Its IUPAC name is 4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine.

Molecular Properties

Compound Name4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
PubChem CID110258581
Molecular FormulaC16H19N3
Molecular Weight253.35 g/mol
Exact Mass253.16
IUPAC Name4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
SMILESc1cc(CN2CCCC(c3ccncc3)C2)ccn1
InChIInChI=1S/C16H19N3/c1-2-16(15-5-9-18-10-6-15)13-19(11-1)12-14-3-7-17-8-4-14/h3-10,16H,1-2,11-13H2
InChIKeyYIPRVTYOJGXJTI-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

4-[[(3R)-3-pyridin-4-ylpiperidin-1-yl]methyl]pyridin-2-amine
CID 129345169
4-(1-benzylpyrrolidin-3-yl)pyridine
CID 11085844
4-[[(3S)-3-(3-methylphenyl)piperidin-1-yl]methyl]pyridine
CID 95861552
4-[(3-fluoropiperidin-1-yl)methyl]pyridine
CID 171701781
4-[(3-methylpiperidin-1-yl)methyl]pyridine
CID 121401070
4-[(3-methoxypiperidin-1-yl)methyl]pyridine
CID 131702809
2-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyrazine
CID 110256923
2-(pyridin-4-ylmethyl)-1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepine
CID 79006212
4-[[3-(2-bromoethyl)piperidin-1-yl]methyl]pyridine
CID 80690340
4-[[(3S)-3-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidin-1-yl]methyl]pyridine
CID 95110871
5-[(3S)-1-(pyridin-4-ylmethyl)piperidin-3-yl]imidazo[1,2-a]pyrimidine
CID 95828115
4-[1-[[4-[(2S)-1,1,1-trifluoro-3-methylsulfonylpropan-2-yl]phenyl]methyl]piperidin-3-yl]pyridine
CID 159304373

Frequently Asked Questions

What is the IUPAC name of 4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine?
The IUPAC name of 4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine (CID 110258581) is 4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine.
What is the SMILES notation for 4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine?
The canonical SMILES for 4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine is c1cc(CN2CCCC(c3ccncc3)C2)ccn1.
What is the InChIKey of 4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine?
The InChIKey is YIPRVTYOJGXJTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3/c1-2-16(15-5-9-18-10-6-15)13-19(11-1)12-14-3-7-17-8-4-14/h3-10,16H,1-2,11-13H2.
What are the key properties of 4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine?
4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]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 4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine is sourced from PubChem (CID 110258581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).