[2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone

C18H19FN2O2 — CID 70732659

IUPAC[2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone
SMILESCOc1cc(C(=O)N2CCCCC2c2ccc(F)cc2)ccn1
InChIInChI=1S/C18H19FN2O2/c1-23-17-12-14(9-10-20-17)18(22)21-11-3-2-4-16(21)13-5-7-15(19)8-6-13/h5-10,12,16H,2-4,11H2,1H3
InChIKeyVEHTZDDWEQAFTK-UHFFFAOYSA-N
MW314.36 g/mol
LogP3.60
Rot. Bonds3

About [2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone

[2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone (PubChem CID 70732659) has the molecular formula C18H19FN2O2 and a molecular weight of 314.36 g/mol. Its IUPAC name is [2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone.

Molecular Properties

Compound Name[2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone
PubChem CID70732659
Molecular FormulaC18H19FN2O2
Molecular Weight314.36 g/mol
Exact Mass314.14
IUPAC Name[2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone
SMILESCOc1cc(C(=O)N2CCCCC2c2ccc(F)cc2)ccn1
InChIInChI=1S/C18H19FN2O2/c1-23-17-12-14(9-10-20-17)18(22)21-11-3-2-4-16(21)13-5-7-15(19)8-6-13/h5-10,12,16H,2-4,11H2,1H3
InChIKeyVEHTZDDWEQAFTK-UHFFFAOYSA-N
XLogP3.60
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(4-fluorophenyl)piperidin-1-yl]-(4-hydroxy-3-methoxyphenyl)methanone
CID 70772344
[2-(6-fluoro-1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(2-methoxy-4-pyridinyl)methanone
CID 70776944
[(2R)-2-(4-fluorophenyl)pyrrolidin-1-yl]-(3,4,5-trimethoxyphenyl)methanone
CID 32840665
[2-(2-hydroxyethyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone
CID 84580383
(3-fluorophenyl)-[2-(4-fluorophenyl)pyrrolidin-1-yl]methanone
CID 50747006
(2-fluoro-4-pyridinyl)-(2-phenylpyrrolidin-1-yl)methanone
CID 61294927
[2-(4-fluorophenyl)piperidin-1-yl]-[3-(1,2,4-triazol-4-yl)phenyl]methanone
CID 70775438
[(2R)-2-(4-fluorophenyl)piperidin-1-yl]-[2-(methoxymethyl)-1,3-thiazol-4-yl]methanone
CID 95972666
[2-(4-methoxyphenyl)azepan-1-yl]-[2-(1,2,4-triazol-1-yl)-4-pyridinyl]methanone
CID 51120898
5-[2-(4-fluorophenyl)piperidine-1-carbonyl]-1-methylpyridin-2-one
CID 70770514
[2-(4-fluorophenyl)piperidin-1-yl]-(4-methylsulfonylphenyl)methanone
CID 70754050
[2-(4-fluorophenyl)pyrrolidin-1-yl]-(2-methoxyphenyl)methanone
CID 50747061

Frequently Asked Questions

What is the IUPAC name of [2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone?
The IUPAC name of [2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone (CID 70732659) is [2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone.
What is the SMILES notation for [2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone?
The canonical SMILES for [2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone is COc1cc(C(=O)N2CCCCC2c2ccc(F)cc2)ccn1.
What is the InChIKey of [2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone?
The InChIKey is VEHTZDDWEQAFTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O2/c1-23-17-12-14(9-10-20-17)18(22)21-11-3-2-4-16(21)13-5-7-15(19)8-6-13/h5-10,12,16H,2-4,11H2,1H3.
What are the key properties of [2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone?
[2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone has a molecular weight of 314.36 g/mol, XLogP of 3.60, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluorophenyl)piperidin-1-yl]-(2-methoxy-4-pyridinyl)methanone is sourced from PubChem (CID 70732659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).