(8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine

C10H20N2 — CID 89108367

IUPAC(8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine
SMILESCCN1CCN2CCC[C@@]2(C)C1
InChIInChI=1S/C10H20N2/c1-3-11-7-8-12-6-4-5-10(12,2)9-11/h3-9H2,1-2H3/t10-/m0/s1
InChIKeyGFKBOHCNGIPYPF-JTQLQIEISA-N
MW168.28 g/mol
LogP1.18
Rot. Bonds1

About (8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine

(8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine (PubChem CID 89108367) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is (8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine.

Molecular Properties

Compound Name(8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine
PubChem CID89108367
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name(8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine
SMILESCCN1CCN2CCC[C@@]2(C)C1
InChIInChI=1S/C10H20N2/c1-3-11-7-8-12-6-4-5-10(12,2)9-11/h3-9H2,1-2H3/t10-/m0/s1
InChIKeyGFKBOHCNGIPYPF-JTQLQIEISA-N
XLogP1.18
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine?
The IUPAC name of (8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine (CID 89108367) is (8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine.
What is the SMILES notation for (8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine?
The canonical SMILES for (8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine is CCN1CCN2CCC[C@@]2(C)C1.
What is the InChIKey of (8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine?
The InChIKey is GFKBOHCNGIPYPF-JTQLQIEISA-N. The full InChI is InChI=1S/C10H20N2/c1-3-11-7-8-12-6-4-5-10(12,2)9-11/h3-9H2,1-2H3/t10-/m0/s1.
What are the key properties of (8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine?
(8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine has a molecular weight of 168.28 g/mol, XLogP of 1.18, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8aS)-2-ethyl-8a-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine is sourced from PubChem (CID 89108367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).