2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine

C9H18N2 — CID 18685120

IUPAC2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine
SMILESCN1CCN2CCCC2(C)C1
InChIInChI=1S/C9H18N2/c1-9-4-3-5-11(9)7-6-10(2)8-9/h3-8H2,1-2H3
InChIKeyHJBNVFPQWPNAFV-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.79
Rot. Bonds

About 2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine

2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine (PubChem CID 18685120) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine.

Molecular Properties

Compound Name2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine
PubChem CID18685120
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine
SMILESCN1CCN2CCCC2(C)C1
InChIInChI=1S/C9H18N2/c1-9-4-3-5-11(9)7-6-10(2)8-9/h3-8H2,1-2H3
InChIKeyHJBNVFPQWPNAFV-UHFFFAOYSA-N
XLogP0.79
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine?
The IUPAC name of 2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine (CID 18685120) is 2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine.
What is the SMILES notation for 2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine?
The canonical SMILES for 2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine is CN1CCN2CCCC2(C)C1.
What is the InChIKey of 2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine?
The InChIKey is HJBNVFPQWPNAFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-9-4-3-5-11(9)7-6-10(2)8-9/h3-8H2,1-2H3.
What are the key properties of 2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine?
2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine has a molecular weight of 154.26 g/mol, XLogP of 0.79, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8a-dimethyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine is sourced from PubChem (CID 18685120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).