8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol

C12H15FN2O — CID 63762633

IUPAC8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol
SMILESOC1CC2CCC(C1)N2c1ccc(F)cn1
InChIInChI=1S/C12H15FN2O/c13-8-1-4-12(14-7-8)15-9-2-3-10(15)6-11(16)5-9/h1,4,7,9-11,16H,2-3,5-6H2
InChIKeyWNVYZMQEKDTRQB-UHFFFAOYSA-N
MW222.26 g/mol
LogP1.71
Rot. Bonds1

About 8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol

8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol (PubChem CID 63762633) has the molecular formula C12H15FN2O and a molecular weight of 222.26 g/mol. Its IUPAC name is 8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol.

Molecular Properties

Compound Name8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol
PubChem CID63762633
Molecular FormulaC12H15FN2O
Molecular Weight222.26 g/mol
Exact Mass222.12
IUPAC Name8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol
SMILESOC1CC2CCC(C1)N2c1ccc(F)cn1
InChIInChI=1S/C12H15FN2O/c13-8-1-4-12(14-7-8)15-9-2-3-10(15)6-11(16)5-9/h1,4,7,9-11,16H,2-3,5-6H2
InChIKeyWNVYZMQEKDTRQB-UHFFFAOYSA-N
XLogP1.71
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.26
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-((3-fluoropyridin-2-yl)(methyl)amino)propan-1-ol
CID 126787150
1-(Pyridin-2-yl)piperidin-4-ol
CID 10607417
1-(Pyridin-2-yl)pyrrolidin-3-ol
CID 21702798
1-(5-(Trifluoromethyl)pyridin-2-yl)piperidin-4-ol
CID 21897605
3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-3-ol
CID 22308694
(3R)-1-(pyridin-2-yl)pyrrolidin-3-ol
CID 53945591
(3S)-1-(2-Pyridinyl)-3-pyrrolidinol
CID 67266355
[1-(3-Fluoro-2-pyridinyl)-3-propylpiperidin-3-yl]methanol
CID 70737720
[(3R*,4R*)-4-[(4-ethylpiperazin-1-yl)methyl]-1-(3-fluoropyridin-2-yl)pyrrolidin-3-yl]methanol
CID 72850983
1-(Pyridin-2-yl)piperidin-4-ol hydrochloride
CID 165871648
(3S)-1-(3-fluoro-2-pyridinyl)-4,4-dimethylpyrrolidin-3-ol
CID 129479886
(3S)-1-(3-fluoropyridin-2-yl)-4,4-dimethylpyrrolidin-3-ol
CID 129479887

Frequently Asked Questions

What is the IUPAC name of 8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol?
The IUPAC name of 8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol (CID 63762633) is 8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol.
What is the SMILES notation for 8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol?
The canonical SMILES for 8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol is OC1CC2CCC(C1)N2c1ccc(F)cn1.
What is the InChIKey of 8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol?
The InChIKey is WNVYZMQEKDTRQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O/c13-8-1-4-12(14-7-8)15-9-2-3-10(15)6-11(16)5-9/h1,4,7,9-11,16H,2-3,5-6H2.
What are the key properties of 8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol?
8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol has a molecular weight of 222.26 g/mol, XLogP of 1.71, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(5-fluoro-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-ol is sourced from PubChem (CID 63762633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).