(3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone

C11H13FN2O2 — CID 64950699

IUPAC(3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone
SMILESO=C(c1ccncc1F)N1CCC(O)CC1
InChIInChI=1S/C11H13FN2O2/c12-10-7-13-4-1-9(10)11(16)14-5-2-8(15)3-6-14/h1,4,7-8,15H,2-3,5-6H2
InChIKeyHBJZELHPARYTMD-UHFFFAOYSA-N
MW224.23 g/mol
LogP0.82
Rot. Bonds1

About (3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone

(3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone (PubChem CID 64950699) has the molecular formula C11H13FN2O2 and a molecular weight of 224.23 g/mol. Its IUPAC name is (3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone.

Molecular Properties

Compound Name(3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone
PubChem CID64950699
Molecular FormulaC11H13FN2O2
Molecular Weight224.23 g/mol
Exact Mass224.10
IUPAC Name(3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone
SMILESO=C(c1ccncc1F)N1CCC(O)CC1
InChIInChI=1S/C11H13FN2O2/c12-10-7-13-4-1-9(10)11(16)14-5-2-8(15)3-6-14/h1,4,7-8,15H,2-3,5-6H2
InChIKeyHBJZELHPARYTMD-UHFFFAOYSA-N
XLogP0.82
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.23
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-fluoro-4-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 66291522
(3-fluoro-4-pyridinyl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone
CID 115646457
(3-fluoro-4-pyridinyl)-(4-piperidin-4-ylpiperidin-1-yl)methanone;hydrochloride
CID 154920114
[4-(ethylamino)piperidin-1-yl]-(3-fluoro-4-pyridinyl)methanone
CID 64950641
1-(3-fluoropyridine-4-carbonyl)-N,N-dimethylpiperidine-4-carboxamide
CID 115646226
(3S)-1-(3-fluoropyridine-4-carbonyl)pyrrolidine-3-carboxylic acid
CID 124511893
(4-chloro-3-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone
CID 81226182
(4-cyclopropylidenepiperidin-1-yl)-(3-fluoro-4-pyridinyl)methanone
CID 121184189
[3-(chloromethyl)pyrrolidin-1-yl]-(3-fluoro-4-pyridinyl)methanone
CID 64956102
(3-fluoro-4-pyridinyl)-[(1S,6S)-7-oxa-3-azabicyclo[4.1.0]heptan-3-yl]methanone
CID 124854532
(3-fluoro-4-pyridinyl)-[4-[1-(1H-pyrazole-5-carbonyl)piperidin-4-yl]piperidin-1-yl]methanone
CID 155507207
(3-fluoro-4-pyridinyl)-(3-methylpiperidin-1-yl)methanone
CID 115646202

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone?
The IUPAC name of (3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone (CID 64950699) is (3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone.
What is the SMILES notation for (3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone?
The canonical SMILES for (3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone is O=C(c1ccncc1F)N1CCC(O)CC1.
What is the InChIKey of (3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone?
The InChIKey is HBJZELHPARYTMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O2/c12-10-7-13-4-1-9(10)11(16)14-5-2-8(15)3-6-14/h1,4,7-8,15H,2-3,5-6H2.
What are the key properties of (3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone?
(3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone has a molecular weight of 224.23 g/mol, XLogP of 0.82, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone is sourced from PubChem (CID 64950699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).