2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane

C11H13FN2 — CID 127437089

IUPAC2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane
SMILESFc1cccnc1N1CC2CCC1C2
InChIInChI=1S/C11H13FN2/c12-10-2-1-5-13-11(10)14-7-8-3-4-9(14)6-8/h1-2,5,8-9H,3-4,6-7H2
InChIKeyLYTHJGAALDKNDY-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.21
Rot. Bonds1

About 2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane

2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane (PubChem CID 127437089) has the molecular formula C11H13FN2 and a molecular weight of 192.24 g/mol. Its IUPAC name is 2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane.

Molecular Properties

Compound Name2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane
PubChem CID127437089
Molecular FormulaC11H13FN2
Molecular Weight192.24 g/mol
Exact Mass192.11
IUPAC Name2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane
SMILESFc1cccnc1N1CC2CCC1C2
InChIInChI=1S/C11H13FN2/c12-10-2-1-5-13-11(10)14-7-8-3-4-9(14)6-8/h1-2,5,8-9H,3-4,6-7H2
InChIKeyLYTHJGAALDKNDY-UHFFFAOYSA-N
XLogP2.21
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane with MolForge

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Related Compounds

2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine
CID 98787854
[2-(2-azabicyclo[2.2.1]heptan-2-yl)-3-fluoro-4-pyridinyl]methanamine
CID 105389495
2-(2-azabicyclo[2.2.1]heptan-2-yl)-N'-hydroxypyridine-3-carboximidamide
CID 54980530
(1R,4S)-2-(4-pyrimidin-2-ylphenyl)-2-azabicyclo[2.2.1]heptane
CID 70792646
propan-2-yl 2-(2-azabicyclo[2.2.1]heptan-2-yl)pyridine-3-carboxylate
CID 133468417
1-[2-(2-azabicyclo[2.2.1]heptan-2-yl)-6-fluorophenyl]ethanone
CID 61224051
2-(3-bromopyrrolidin-1-yl)-3-fluoropyridine
CID 80666888
2-(3-chloro-4-methylpiperidin-1-yl)-3-fluoropyridine
CID 102960811
2-(3-fluoro-2-pyridinyl)-5-(2-pyrazol-1-ylethyl)-2,5-diazabicyclo[2.2.1]heptane
CID 172899537
(6aS,10aS,11aS)-2-(3-fluoro-2-pyridinyl)-1,3,4,6,6a,7,8,9,10,10a,11,11a-dodecahydropyrazino[1,2-b]isoquinoline
CID 57126142
4-[1-(3-fluoro-2-pyridinyl)pyrrolidin-3-yl]morpholine
CID 172905301
tert-butyl 5-(3-fluoro-2-pyridinyl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate
CID 172906255

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane?
The IUPAC name of 2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane (CID 127437089) is 2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane.
What is the SMILES notation for 2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane?
The canonical SMILES for 2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane is Fc1cccnc1N1CC2CCC1C2.
What is the InChIKey of 2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane?
The InChIKey is LYTHJGAALDKNDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2/c12-10-2-1-5-13-11(10)14-7-8-3-4-9(14)6-8/h1-2,5,8-9H,3-4,6-7H2.
What are the key properties of 2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane?
2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane has a molecular weight of 192.24 g/mol, XLogP of 2.21, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane is sourced from PubChem (CID 127437089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).