[4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone

C16H16FN3O3 — CID 154846075

IUPAC[4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone
SMILESO=C(c1ccc(O)cn1)N1CCC(Oc2ncccc2F)CC1
InChIInChI=1S/C16H16FN3O3/c17-13-2-1-7-18-15(13)23-12-5-8-20(9-6-12)16(22)14-4-3-11(21)10-19-14/h1-4,7,10,12,21H,5-6,8-9H2
InChIKeyHUHAVTRCPAENFT-UHFFFAOYSA-N
MW317.32 g/mol
LogP2.00
Rot. Bonds3

About [4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone

[4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone (PubChem CID 154846075) has the molecular formula C16H16FN3O3 and a molecular weight of 317.32 g/mol. Its IUPAC name is [4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone.

Molecular Properties

Compound Name[4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone
PubChem CID154846075
Molecular FormulaC16H16FN3O3
Molecular Weight317.32 g/mol
Exact Mass317.12
IUPAC Name[4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone
SMILESO=C(c1ccc(O)cn1)N1CCC(Oc2ncccc2F)CC1
InChIInChI=1S/C16H16FN3O3/c17-13-2-1-7-18-15(13)23-12-5-8-20(9-6-12)16(22)14-4-3-11(21)10-19-14/h1-4,7,10,12,21H,5-6,8-9H2
InChIKeyHUHAVTRCPAENFT-UHFFFAOYSA-N
XLogP2.00
TPSA75.55 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.32
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)methanone
CID 139006441
2-cyclopentyloxy-3-fluoropyridine
CID 126955068
(5-bromo-2-pyridinyl)-(4-pyridin-3-yloxypiperidin-1-yl)methanone
CID 56643230
[(3S)-3-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-pyridazin-4-ylmethanone
CID 124738553
(4-chloro-2-pyridinyl)-[(3R)-3-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methanone
CID 125139170
(3-fluoro-2-pyridinyl)-[4-(5-pyridin-4-ylpyrimidin-2-yl)oxypiperidin-1-yl]methanone
CID 154583874
isoquinolin-3-yl-[4-[[3-(oxan-4-yl)-2-pyridinyl]oxy]piperidin-1-yl]methanone
CID 54670305
(5-hydroxy-2-pyridinyl)-(4-pyrimidin-4-ylpiperidin-1-yl)methanone
CID 154846130
2-(difluoromethyl)-3-[4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]pyrazine
CID 139001706
[4-[(3-chloro-2-pyridinyl)oxy]piperidin-1-yl]-(2,5-dichlorophenyl)methanone
CID 71798834
[4-[(3-methyl-2-pyridinyl)oxy]piperidin-1-yl]-(4-methyl-1H-pyrrol-3-yl)methanone
CID 122153292
tert-butyl N-[(2S)-1-[4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate
CID 90803087

Frequently Asked Questions

What is the IUPAC name of [4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone?
The IUPAC name of [4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone (CID 154846075) is [4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone.
What is the SMILES notation for [4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone?
The canonical SMILES for [4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone is O=C(c1ccc(O)cn1)N1CCC(Oc2ncccc2F)CC1.
What is the InChIKey of [4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone?
The InChIKey is HUHAVTRCPAENFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3O3/c17-13-2-1-7-18-15(13)23-12-5-8-20(9-6-12)16(22)14-4-3-11(21)10-19-14/h1-4,7,10,12,21H,5-6,8-9H2.
What are the key properties of [4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone?
[4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone has a molecular weight of 317.32 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-(5-hydroxy-2-pyridinyl)methanone is sourced from PubChem (CID 154846075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).