8-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane

C11H14FN3 — CID 164646891

IUPAC8-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane
SMILESFc1cncc(N2C3CCCC2CC3)n1
InChIInChI=1S/C11H14FN3/c12-10-6-13-7-11(14-10)15-8-2-1-3-9(15)5-4-8/h6-9H,1-5H2
InChIKeyVGVPZWKKMQECLS-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.14
Rot. Bonds1

About 8-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane

8-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane (PubChem CID 164646891) has the molecular formula C11H14FN3 and a molecular weight of 207.25 g/mol. Its IUPAC name is 8-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name8-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane
PubChem CID164646891
Molecular FormulaC11H14FN3
Molecular Weight207.25 g/mol
Exact Mass207.12
IUPAC Name8-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane
SMILESFc1cncc(N2C3CCCC2CC3)n1
InChIInChI=1S/C11H14FN3/c12-10-6-13-7-11(14-10)15-8-2-1-3-9(15)5-4-8/h6-9H,1-5H2
InChIKeyVGVPZWKKMQECLS-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-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane?
The IUPAC name of 8-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane (CID 164646891) is 8-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane.
What is the SMILES notation for 8-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane?
The canonical SMILES for 8-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane is Fc1cncc(N2C3CCCC2CC3)n1.
What is the InChIKey of 8-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane?
The InChIKey is VGVPZWKKMQECLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN3/c12-10-6-13-7-11(14-10)15-8-2-1-3-9(15)5-4-8/h6-9H,1-5H2.
What are the key properties of 8-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane?
8-(6-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-(6-fluoropyrazin-2-yl)-8-azabicyclo[3.2.1]octane is sourced from PubChem (CID 164646891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).