6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine

C8H13N3 — CID 142129312

IUPAC6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine
SMILESCN1CCN2N=CC=CC2C1
InChIInChI=1S/C8H13N3/c1-10-5-6-11-8(7-10)3-2-4-9-11/h2-4,8H,5-7H2,1H3
InChIKeyLIIRCLJSWNDCGI-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.16
Rot. Bonds

About 6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine

6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine (PubChem CID 142129312) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine.

Molecular Properties

Compound Name6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine
PubChem CID142129312
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine
SMILESCN1CCN2N=CC=CC2C1
InChIInChI=1S/C8H13N3/c1-10-5-6-11-8(7-10)3-2-4-9-11/h2-4,8H,5-7H2,1H3
InChIKeyLIIRCLJSWNDCGI-UHFFFAOYSA-N
XLogP0.16
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-4a,8a-dihydro-2H-1,5-naphthyridine
CID 166864798
1-(2,3-Dihydropyridin-3-yl)-4-methylpiperazine
CID 173103431
6-Methyl-3,5,7,8-tetrahydropyrazino[1,2-b]pyridazine
CID 144720853

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine?
The IUPAC name of 6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine (CID 142129312) is 6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine.
What is the SMILES notation for 6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine?
The canonical SMILES for 6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine is CN1CCN2N=CC=CC2C1.
What is the InChIKey of 6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine?
The InChIKey is LIIRCLJSWNDCGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-10-5-6-11-8(7-10)3-2-4-9-11/h2-4,8H,5-7H2,1H3.
What are the key properties of 6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine?
6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine has a molecular weight of 151.21 g/mol, XLogP of 0.16, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4a,5,7,8-tetrahydropyrazino[1,2-b]pyridazine is sourced from PubChem (CID 142129312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).