6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline

C10H10F2N2 — CID 147138512

IUPAC6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline
SMILESCC1=C(C)NC2C=C(F)C(F)=CC2=N1
InChIInChI=1S/C10H10F2N2/c1-5-6(2)14-10-4-8(12)7(11)3-9(10)13-5/h3-4,9,13H,1-2H3
InChIKeyBRQISTQIRUAEMA-UHFFFAOYSA-N
MW196.20 g/mol
LogP2.37
Rot. Bonds

About 6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline

6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline (PubChem CID 147138512) has the molecular formula C10H10F2N2 and a molecular weight of 196.20 g/mol. Its IUPAC name is 6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline.

Molecular Properties

Compound Name6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline
PubChem CID147138512
Molecular FormulaC10H10F2N2
Molecular Weight196.20 g/mol
Exact Mass196.08
IUPAC Name6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline
SMILESCC1=C(C)NC2C=C(F)C(F)=CC2=N1
InChIInChI=1S/C10H10F2N2/c1-5-6(2)14-10-4-8(12)7(11)3-9(10)13-5/h3-4,9,13H,1-2H3
InChIKeyBRQISTQIRUAEMA-UHFFFAOYSA-N
XLogP2.37
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.20
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6,7-Difluoro-2-methyl-1,8a-dihydroquinoxaline
CID 154554858
6,7-Difluoro-3-methyl-1,2,4a,8a-tetrahydroquinoxaline
CID 164085607
1,4,5,5a-Tetrahydrophenazine
CID 23504326
2-Propan-2-yl-1,8a-dihydroquinoxaline
CID 88995422
3-Methyl-1,8a-dihydroquinoxaline
CID 141970301
2-Chloro-3-methyl-1,8a-dihydroquinoxalin-1-ium
CID 163808024
2-Chloro-3-methyl-1,8a-dihydroquinoxaline
CID 163808025

Frequently Asked Questions

What is the IUPAC name of 6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline?
The IUPAC name of 6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline (CID 147138512) is 6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline.
What is the SMILES notation for 6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline?
The canonical SMILES for 6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline is CC1=C(C)NC2C=C(F)C(F)=CC2=N1.
What is the InChIKey of 6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline?
The InChIKey is BRQISTQIRUAEMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2N2/c1-5-6(2)14-10-4-8(12)7(11)3-9(10)13-5/h3-4,9,13H,1-2H3.
What are the key properties of 6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline?
6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline has a molecular weight of 196.20 g/mol, XLogP of 2.37, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline is sourced from PubChem (CID 147138512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).