7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline

C11H15FN2 — CID 84619291

IUPAC7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline
SMILESCC1Nc2cc(F)ccc2N(C)C1C
InChIInChI=1S/C11H15FN2/c1-7-8(2)14(3)11-5-4-9(12)6-10(11)13-7/h4-8,13H,1-3H3
InChIKeyKZNZDKFUMQRMJD-UHFFFAOYSA-N
MW194.25 g/mol
LogP2.46
Rot. Bonds

About 7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline

7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline (PubChem CID 84619291) has the molecular formula C11H15FN2 and a molecular weight of 194.25 g/mol. Its IUPAC name is 7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline.

Molecular Properties

Compound Name7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline
PubChem CID84619291
Molecular FormulaC11H15FN2
Molecular Weight194.25 g/mol
Exact Mass194.12
IUPAC Name7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline
SMILESCC1Nc2cc(F)ccc2N(C)C1C
InChIInChI=1S/C11H15FN2/c1-7-8(2)14(3)11-5-4-9(12)6-10(11)13-7/h4-8,13H,1-3H3
InChIKeyKZNZDKFUMQRMJD-UHFFFAOYSA-N
XLogP2.46
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline 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 7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline?
The IUPAC name of 7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline (CID 84619291) is 7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline.
What is the SMILES notation for 7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline?
The canonical SMILES for 7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline is CC1Nc2cc(F)ccc2N(C)C1C.
What is the InChIKey of 7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline?
The InChIKey is KZNZDKFUMQRMJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2/c1-7-8(2)14(3)11-5-4-9(12)6-10(11)13-7/h4-8,13H,1-3H3.
What are the key properties of 7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline?
7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline has a molecular weight of 194.25 g/mol, XLogP of 2.46, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline is sourced from PubChem (CID 84619291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).