8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine

C12H18N4 — CID 83062615

IUPAC8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESCc1nccnc1N1C2CCC1CC(N)C2
InChIInChI=1S/C12H18N4/c1-8-12(15-5-4-14-8)16-10-2-3-11(16)7-9(13)6-10/h4-5,9-11H,2-3,6-7,13H2,1H3
InChIKeyCAEYVJFWZSYVAI-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.24
Rot. Bonds1

About 8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine

8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 83062615) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is 8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound Name8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID83062615
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC Name8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESCc1nccnc1N1C2CCC1CC(N)C2
InChIInChI=1S/C12H18N4/c1-8-12(15-5-4-14-8)16-10-2-3-11(16)7-9(13)6-10/h4-5,9-11H,2-3,6-7,13H2,1H3
InChIKeyCAEYVJFWZSYVAI-UHFFFAOYSA-N
XLogP1.24
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of 8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine (CID 83062615) is 8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for 8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for 8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine is Cc1nccnc1N1C2CCC1CC(N)C2.
What is the InChIKey of 8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is CAEYVJFWZSYVAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-8-12(15-5-4-14-8)16-10-2-3-11(16)7-9(13)6-10/h4-5,9-11H,2-3,6-7,13H2,1H3.
What are the key properties of 8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine?
8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 218.30 g/mol, XLogP of 1.24, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-methylpyrazin-2-yl)-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 83062615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).