3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine

C17H19FN2 — CID 16674606

IUPAC3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine
SMILESFc1ccc(C2CCN(Cc3cccnc3)CC2)cc1
InChIInChI=1S/C17H19FN2/c18-17-5-3-15(4-6-17)16-7-10-20(11-8-16)13-14-2-1-9-19-12-14/h1-6,9,12,16H,7-8,10-11,13H2
InChIKeyXURLKIVSAQCQLY-UHFFFAOYSA-N
MW270.35 g/mol
LogP3.60
Rot. Bonds3

About 3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine

3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine (PubChem CID 16674606) has the molecular formula C17H19FN2 and a molecular weight of 270.35 g/mol. Its IUPAC name is 3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine.

Molecular Properties

Compound Name3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine
PubChem CID16674606
Molecular FormulaC17H19FN2
Molecular Weight270.35 g/mol
Exact Mass270.15
IUPAC Name3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine
SMILESFc1ccc(C2CCN(Cc3cccnc3)CC2)cc1
InChIInChI=1S/C17H19FN2/c18-17-5-3-15(4-6-17)16-7-10-20(11-8-16)13-14-2-1-9-19-12-14/h1-6,9,12,16H,7-8,10-11,13H2
InChIKeyXURLKIVSAQCQLY-UHFFFAOYSA-N
XLogP3.60
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrrolidin-1-yl]methyl]pyridine
CID 91916522
3-[[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]pyridine
CID 71999804
1-(pyridin-3-ylmethyl)piperidine-4-carbaldehyde
CID 42556102
3-[[3-[5-[(4-fluorophenoxy)methyl]-1H-pyrazol-3-yl]pyrrolidin-1-yl]methyl]pyridine
CID 127252203
3-(pyrrolidin-1-ylmethyl)pyridine;dihydrochloride
CID 119103446
2-fluoro-5-methyl-4-[1-(pyridin-3-ylmethyl)piperidin-4-yl]aniline
CID 89112762
8-[(4-fluorophenyl)methyl]-1-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decane
CID 97372598
3-[[4-[3-[2-(4-fluorophenyl)ethyl]piperidin-1-yl]piperidin-1-yl]methyl]pyridine
CID 56880067
N-(4-fluorophenyl)-4-methyl-N-[1-(pyridin-3-ylmethyl)piperidin-4-yl]benzenesulfonamide
CID 46055362
4-[1-(pyridin-3-ylmethyl)piperidin-4-yl]-1H-pyrrolo[2,3-b]pyridine
CID 141455734
2-[1-(pyridin-3-ylmethyl)piperidin-4-yl]ethanamine;hydrochloride
CID 17245035
3-[(4,4-difluoropiperidin-1-yl)methyl]pyridine
CID 117007748

Frequently Asked Questions

What is the IUPAC name of 3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine?
The IUPAC name of 3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine (CID 16674606) is 3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine.
What is the SMILES notation for 3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine?
The canonical SMILES for 3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine is Fc1ccc(C2CCN(Cc3cccnc3)CC2)cc1.
What is the InChIKey of 3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine?
The InChIKey is XURLKIVSAQCQLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2/c18-17-5-3-15(4-6-17)16-7-10-20(11-8-16)13-14-2-1-9-19-12-14/h1-6,9,12,16H,7-8,10-11,13H2.
What are the key properties of 3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine?
3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine has a molecular weight of 270.35 g/mol, XLogP of 3.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine is sourced from PubChem (CID 16674606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).