2-methyl-4a,8a-dihydroquinoxaline

C9H10N2 — CID 89172182

IUPAC2-methyl-4a,8a-dihydroquinoxaline
SMILESCC1=NC2C=CC=CC2N=C1
InChIInChI=1S/C9H10N2/c1-7-6-10-8-4-2-3-5-9(8)11-7/h2-6,8-9H,1H3
InChIKeyUCOAYJVSCFCAOQ-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.39
Rot. Bonds

About 2-methyl-4a,8a-dihydroquinoxaline

2-methyl-4a,8a-dihydroquinoxaline (PubChem CID 89172182) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 2-methyl-4a,8a-dihydroquinoxaline.

Molecular Properties

Compound Name2-methyl-4a,8a-dihydroquinoxaline
PubChem CID89172182
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name2-methyl-4a,8a-dihydroquinoxaline
SMILESCC1=NC2C=CC=CC2N=C1
InChIInChI=1S/C9H10N2/c1-7-6-10-8-4-2-3-5-9(8)11-7/h2-6,8-9H,1H3
InChIKeyUCOAYJVSCFCAOQ-UHFFFAOYSA-N
XLogP1.39
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4a,8a-dihydroquinoxaline?
The IUPAC name of 2-methyl-4a,8a-dihydroquinoxaline (CID 89172182) is 2-methyl-4a,8a-dihydroquinoxaline.
What is the SMILES notation for 2-methyl-4a,8a-dihydroquinoxaline?
The canonical SMILES for 2-methyl-4a,8a-dihydroquinoxaline is CC1=NC2C=CC=CC2N=C1.
What is the InChIKey of 2-methyl-4a,8a-dihydroquinoxaline?
The InChIKey is UCOAYJVSCFCAOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2/c1-7-6-10-8-4-2-3-5-9(8)11-7/h2-6,8-9H,1H3.
What are the key properties of 2-methyl-4a,8a-dihydroquinoxaline?
2-methyl-4a,8a-dihydroquinoxaline has a molecular weight of 146.19 g/mol, XLogP of 1.39, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4a,8a-dihydroquinoxaline is sourced from PubChem (CID 89172182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).