5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine

C16H18FN3 — CID 124957202

IUPAC5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine
SMILESFc1ccc(N2CCC[C@H](Cc3cccnc3)C2)nc1
InChIInChI=1S/C16H18FN3/c17-15-5-6-16(19-11-15)20-8-2-4-14(12-20)9-13-3-1-7-18-10-13/h1,3,5-7,10-11,14H,2,4,8-9,12H2/t14-/m1/s1
InChIKeyFXEQLFKYLPPLOR-CQSZACIVSA-N
MW271.34 g/mol
LogP3.07
Rot. Bonds3

About 5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine

5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine (PubChem CID 124957202) has the molecular formula C16H18FN3 and a molecular weight of 271.34 g/mol. Its IUPAC name is 5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine.

Molecular Properties

Compound Name5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine
PubChem CID124957202
Molecular FormulaC16H18FN3
Molecular Weight271.34 g/mol
Exact Mass271.15
IUPAC Name5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine
SMILESFc1ccc(N2CCC[C@H](Cc3cccnc3)C2)nc1
InChIInChI=1S/C16H18FN3/c17-15-5-6-16(19-11-15)20-8-2-4-14(12-20)9-13-3-1-7-18-10-13/h1,3,5-7,10-11,14H,2,4,8-9,12H2/t14-/m1/s1
InChIKeyFXEQLFKYLPPLOR-CQSZACIVSA-N
XLogP3.07
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-fluoro-2-[3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine
CID 110103363
2-[3-(bromomethyl)piperidin-1-yl]-5-fluoropyridine
CID 80672753
1-[1-(5-fluoro-2-pyridinyl)piperidin-3-yl]-N-methylmethanamine
CID 61313343
(3R)-1-(5-fluoro-2-pyridinyl)piperidin-3-ol
CID 58565962
2-[[3-(pyridin-3-ylmethyl)piperidin-1-yl]methyl]-1,3-thiazole
CID 127246448
4-methyl-6-[(3R)-3-(pyridin-3-ylmethyl)pyrrolidin-1-yl]pyrimidine
CID 124945029
[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]-(2-pyrrolidin-1-yl-4-pyridinyl)methanone
CID 125009158
6-[[(3R)-1-(5-fluoro-2-pyridinyl)piperidin-3-yl]methyl]-2-methylpyrimidine-4-carboxamide
CID 125020264
2-hydroxy-1-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]ethanone
CID 95841872
(6-pyrazol-1-yl-3-pyridinyl)-[(3S)-3-(pyridin-3-ylmethyl)piperidin-1-yl]methanone
CID 125000089
4-[3-(pyridin-3-ylmethyl)piperidin-1-yl]-3-(tetrazolidin-5-yl)pyridine-2-sulfonamide
CID 134823578
pyridin-4-yl-[3-(pyridin-3-ylmethyl)piperidin-1-yl]methanone
CID 110096200

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine?
The IUPAC name of 5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine (CID 124957202) is 5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine.
What is the SMILES notation for 5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine?
The canonical SMILES for 5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine is Fc1ccc(N2CCC[C@H](Cc3cccnc3)C2)nc1.
What is the InChIKey of 5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine?
The InChIKey is FXEQLFKYLPPLOR-CQSZACIVSA-N. The full InChI is InChI=1S/C16H18FN3/c17-15-5-6-16(19-11-15)20-8-2-4-14(12-20)9-13-3-1-7-18-10-13/h1,3,5-7,10-11,14H,2,4,8-9,12H2/t14-/m1/s1.
What are the key properties of 5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine?
5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine has a molecular weight of 271.34 g/mol, XLogP of 3.07, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-[(3R)-3-(pyridin-3-ylmethyl)piperidin-1-yl]pyridine is sourced from PubChem (CID 124957202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).