8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane

C11H14FN3 — CID 164648196

IUPAC8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane
SMILESFc1nccnc1N1C2CCCC1CC2
InChIInChI=1S/C11H14FN3/c12-10-11(14-7-6-13-10)15-8-2-1-3-9(15)5-4-8/h6-9H,1-5H2
InChIKeyCRCFFUIKVYRPSY-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.14
Rot. Bonds1

About 8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane

8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane (PubChem CID 164648196) has the molecular formula C11H14FN3 and a molecular weight of 207.25 g/mol. Its IUPAC name is 8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane
PubChem CID164648196
Molecular FormulaC11H14FN3
Molecular Weight207.25 g/mol
Exact Mass207.12
IUPAC Name8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane
SMILESFc1nccnc1N1C2CCCC1CC2
InChIInChI=1S/C11H14FN3/c12-10-11(14-7-6-13-10)15-8-2-1-3-9(15)5-4-8/h6-9H,1-5H2
InChIKeyCRCFFUIKVYRPSY-UHFFFAOYSA-N
XLogP2.14
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane?
The IUPAC name of 8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane (CID 164648196) is 8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane.
What is the SMILES notation for 8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane?
The canonical SMILES for 8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane is Fc1nccnc1N1C2CCCC1CC2.
What is the InChIKey of 8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane?
The InChIKey is CRCFFUIKVYRPSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN3/c12-10-11(14-7-6-13-10)15-8-2-1-3-9(15)5-4-8/h6-9H,1-5H2.
What are the key properties of 8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane?
8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane has a molecular weight of 207.25 g/mol, XLogP of 2.14, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane is sourced from PubChem (CID 164648196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).