3,4-dimethyl-4aH-quinoxaline

C10H12N2 — CID 149289450

IUPAC3,4-dimethyl-4aH-quinoxaline
SMILESCC1=CN=C2C=CC=CC2N1C
InChIInChI=1S/C10H12N2/c1-8-7-11-9-5-3-4-6-10(9)12(8)2/h3-7,10H,1-2H3
InChIKeyXUNURFYPYRGKSM-UHFFFAOYSA-N
MW160.22 g/mol
LogP1.73
Rot. Bonds

About 3,4-dimethyl-4aH-quinoxaline

3,4-dimethyl-4aH-quinoxaline (PubChem CID 149289450) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 3,4-dimethyl-4aH-quinoxaline.

Molecular Properties

Compound Name3,4-dimethyl-4aH-quinoxaline
PubChem CID149289450
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name3,4-dimethyl-4aH-quinoxaline
SMILESCC1=CN=C2C=CC=CC2N1C
InChIInChI=1S/C10H12N2/c1-8-7-11-9-5-3-4-6-10(9)12(8)2/h3-7,10H,1-2H3
InChIKeyXUNURFYPYRGKSM-UHFFFAOYSA-N
XLogP1.73
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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1-Ethylpyrrolo[2,3-h]quinoline
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2,3-Dimethylpyridazino [4,5-b]quinoxaline
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CID 129800346
N-ethylpyrroloindole
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2-Diethylamino-3h-acridine
CID 137346134
5-Ethyl-4a,10a-dihydrophenazin-5-ium
CID 138969017
N-propan-2-yl-3,4-dihydroquinolizin-2-imine
CID 145918539
Oopcllihquxqnn-uhfffaoysa-
CID 606713

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-4aH-quinoxaline?
The IUPAC name of 3,4-dimethyl-4aH-quinoxaline (CID 149289450) is 3,4-dimethyl-4aH-quinoxaline.
What is the SMILES notation for 3,4-dimethyl-4aH-quinoxaline?
The canonical SMILES for 3,4-dimethyl-4aH-quinoxaline is CC1=CN=C2C=CC=CC2N1C.
What is the InChIKey of 3,4-dimethyl-4aH-quinoxaline?
The InChIKey is XUNURFYPYRGKSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-8-7-11-9-5-3-4-6-10(9)12(8)2/h3-7,10H,1-2H3.
What are the key properties of 3,4-dimethyl-4aH-quinoxaline?
3,4-dimethyl-4aH-quinoxaline has a molecular weight of 160.22 g/mol, XLogP of 1.73, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-4aH-quinoxaline is sourced from PubChem (CID 149289450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).