(1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol

C19H23FN2O — CID 97275827

IUPAC(1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol
SMILESO[C@H](CCc1ccccc1)C1CCN(c2ccncc2F)CC1
InChIInChI=1S/C19H23FN2O/c20-17-14-21-11-8-18(17)22-12-9-16(10-13-22)19(23)7-6-15-4-2-1-3-5-15/h1-5,8,11,14,16,19,23H,6-7,9-10,12-13H2/t19-/m1/s1
InChIKeyKZLAZNRPXUDHLW-LJQANCHMSA-N
MW314.40 g/mol
LogP3.43
Rot. Bonds5

About (1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol

(1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol (PubChem CID 97275827) has the molecular formula C19H23FN2O and a molecular weight of 314.40 g/mol. Its IUPAC name is (1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol.

Molecular Properties

Compound Name(1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol
PubChem CID97275827
Molecular FormulaC19H23FN2O
Molecular Weight314.40 g/mol
Exact Mass314.18
IUPAC Name(1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol
SMILESO[C@H](CCc1ccccc1)C1CCN(c2ccncc2F)CC1
InChIInChI=1S/C19H23FN2O/c20-17-14-21-11-8-18(17)22-12-9-16(10-13-22)19(23)7-6-15-4-2-1-3-5-15/h1-5,8,11,14,16,19,23H,6-7,9-10,12-13H2/t19-/m1/s1
InChIKeyKZLAZNRPXUDHLW-LJQANCHMSA-N
XLogP3.43
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.40
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(2-Phenylethyl)-4-(pyridin-3-ylmethyl)piperazin-2-yl]ethanol
CID 16189129
4-(3-Fluoro-phenyl)-1-pyridin-4-ylmethyl-piperidin-4-ol
CID 645747
13-[1-(13-Pyridin-3-yltridecyl)pyridin-1-ium-3-yl]tridecan-1-ol iodide
CID 10842120
(7R,9S)-7-((4-phenylpiperidin-1-yl)methyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-ol
CID 24894430
(7R,9S)-7-(((3S,4S)-4-(4-fluoro-2-methylphenyl)-3-hydroxypiperidin-1-yl)methyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-ol
CID 44561020
(2S,3R)-2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-ol
CID 49780189
(R)-2-(2,5-difluorophenyl)-1-(1-(pyridin-4-yl)piperidin-4-yl)ethanamine
CID 53325399
trans-(1R,2R)-2-(4-pyridin-4-ylpiperidin-1-yl)cyclohexan-1-ol
CID 122181170
4-(4-Fluoro-phenyl)-1-pyridin-3-ylmethyl-piperidin-4-ol
CID 3228767
[4-Benzyl-1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol
CID 16188295
(E)-7-phenyl-7-(3-pyridyl)-6-hepten-1-ol
CID 13417327
[(2R,3S,4R)-4-(2-ethylphenyl)-2-phenyl-1-(pyridin-3-ylmethyl)piperidin-3-yl]methanol
CID 44428363

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol?
The IUPAC name of (1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol (CID 97275827) is (1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol.
What is the SMILES notation for (1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol?
The canonical SMILES for (1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol is O[C@H](CCc1ccccc1)C1CCN(c2ccncc2F)CC1.
What is the InChIKey of (1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol?
The InChIKey is KZLAZNRPXUDHLW-LJQANCHMSA-N. The full InChI is InChI=1S/C19H23FN2O/c20-17-14-21-11-8-18(17)22-12-9-16(10-13-22)19(23)7-6-15-4-2-1-3-5-15/h1-5,8,11,14,16,19,23H,6-7,9-10,12-13H2/t19-/m1/s1.
What are the key properties of (1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol?
(1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol has a molecular weight of 314.40 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[1-(3-fluoro-4-pyridinyl)piperidin-4-yl]-3-phenylpropan-1-ol is sourced from PubChem (CID 97275827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).