1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol

C10H12BrFN2O — CID 104918716

IUPAC1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol
SMILESOC1CCCN(c2ncc(Br)cc2F)C1
InChIInChI=1S/C10H12BrFN2O/c11-7-4-9(12)10(13-5-7)14-3-1-2-8(15)6-14/h4-5,8,15H,1-3,6H2
InChIKeyAQVDFTQZDMTIQO-UHFFFAOYSA-N
MW275.12 g/mol
LogP1.94
Rot. Bonds1

About 1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol

1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol (PubChem CID 104918716) has the molecular formula C10H12BrFN2O and a molecular weight of 275.12 g/mol. Its IUPAC name is 1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol.

Molecular Properties

Compound Name1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol
PubChem CID104918716
Molecular FormulaC10H12BrFN2O
Molecular Weight275.12 g/mol
Exact Mass274.01
IUPAC Name1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol
SMILESOC1CCCN(c2ncc(Br)cc2F)C1
InChIInChI=1S/C10H12BrFN2O/c11-7-4-9(12)10(13-5-7)14-3-1-2-8(15)6-14/h4-5,8,15H,1-3,6H2
InChIKeyAQVDFTQZDMTIQO-UHFFFAOYSA-N
XLogP1.94
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.12
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-Bromopyridin-2-yl)morpholine
CID 10966724
1-(Pyridin-2-yl)piperidin-4-ol
CID 10607417
1-(3-Bromo-5-methyl-2-pyridinyl)-4-(cyclohexylamino)piperidin-3-ol
CID 118263675
1-(5-Bromo-3-methanimidoyl-2-pyridinyl)-4-(cyclohexylamino)piperidin-3-ol
CID 118263690
(3R,4R)-1-(5-bromo-3-methanimidoyl-2-pyridinyl)-4-(cyclohexylamino)piperidin-3-ol
CID 118263707
4-(3,5-Dibromopyridin-2-yl)morpholine
CID 66545210
3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-3-ol
CID 22308694
4-(4-Bromopyridin-2-yl)morpholine
CID 51063918
1-(5-Bromopyridin-2-yl)azetidin-3-ol
CID 59139773
2-[(5-Bromo-2-Pyridyl)-Methyl-Amino]ethanol
CID 10657129
(1R,6R)-6-[(5-bromo-2-pyridinyl)-hydroxyamino]cyclohex-2-en-1-ol
CID 44474863
(1R,5R)-5-[(5-bromo-2-pyridinyl)-hydroxyamino]cyclopent-2-en-1-ol
CID 44475300

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol?
The IUPAC name of 1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol (CID 104918716) is 1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol.
What is the SMILES notation for 1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol?
The canonical SMILES for 1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol is OC1CCCN(c2ncc(Br)cc2F)C1.
What is the InChIKey of 1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol?
The InChIKey is AQVDFTQZDMTIQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrFN2O/c11-7-4-9(12)10(13-5-7)14-3-1-2-8(15)6-14/h4-5,8,15H,1-3,6H2.
What are the key properties of 1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol?
1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol has a molecular weight of 275.12 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-3-fluoro-2-pyridinyl)piperidin-3-ol is sourced from PubChem (CID 104918716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).