6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline

C11H14F2N2 — CID 84621650

IUPAC6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline
SMILESCN1c2cc(F)cc(F)c2NCC1(C)C
InChIInChI=1S/C11H14F2N2/c1-11(2)6-14-10-8(13)4-7(12)5-9(10)15(11)3/h4-5,14H,6H2,1-3H3
InChIKeyURHARWVYVDRSBI-UHFFFAOYSA-N
MW212.24 g/mol
LogP2.61
Rot. Bonds

About 6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline

6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline (PubChem CID 84621650) has the molecular formula C11H14F2N2 and a molecular weight of 212.24 g/mol. Its IUPAC name is 6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline.

Molecular Properties

Compound Name6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline
PubChem CID84621650
Molecular FormulaC11H14F2N2
Molecular Weight212.24 g/mol
Exact Mass212.11
IUPAC Name6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline
SMILESCN1c2cc(F)cc(F)c2NCC1(C)C
InChIInChI=1S/C11H14F2N2/c1-11(2)6-14-10-8(13)4-7(12)5-9(10)15(11)3/h4-5,14H,6H2,1-3H3
InChIKeyURHARWVYVDRSBI-UHFFFAOYSA-N
XLogP2.61
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.24
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,3-diethyl-6,8-difluoro-1,2,4,5-tetrahydro-1,5-benzodiazepine
CID 115510199
3-ethyl-5,7-difluoro-3-methyl-1,2-dihydroindole
CID 106701849
6,8-difluoro-2,3,4-trimethyl-2,3-dihydro-1H-quinoxaline
CID 84621651
6,8-difluoro-1,4-dimethyl-2,3,4,5-tetrahydro-1,5-benzodiazepine
CID 84621646
3-(aminomethyl)-6,8-difluoro-4-methyl-1,3-dihydroquinoxalin-2-one
CID 84625224
5,7-difluorospiro[1,2-dihydroindole-3,1'-cycloheptane]
CID 106701866
4-ethyl-6,8-difluoro-3,3-dimethyl-1H-quinoxalin-2-one
CID 115510079
4-ethyl-6,8-difluoro-1,3-dihydroquinoxalin-2-one
CID 115510094
5,7-difluorospiro[1,2-dihydroindole-3,4'-oxane]
CID 106701657
3,3-dimethyl-1-(2,3,5-trifluorophenyl)-1,4-diazepane
CID 64948984
2,4-difluoro-6a,7,7a,8,9,10,11,11a-octahydro-5H-indolo[1,2-a]quinoxalin-6-one
CID 115510048
10-ethyl-6,8-difluoro-3,3a,5,10a-tetrahydro-1H-furo[3,4-b][1,5]benzodiazepin-4-one
CID 115510106

Frequently Asked Questions

What is the IUPAC name of 6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline?
The IUPAC name of 6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline (CID 84621650) is 6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline.
What is the SMILES notation for 6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline?
The canonical SMILES for 6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline is CN1c2cc(F)cc(F)c2NCC1(C)C.
What is the InChIKey of 6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline?
The InChIKey is URHARWVYVDRSBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N2/c1-11(2)6-14-10-8(13)4-7(12)5-9(10)15(11)3/h4-5,14H,6H2,1-3H3.
What are the key properties of 6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline?
6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline has a molecular weight of 212.24 g/mol, XLogP of 2.61, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-difluoro-3,3,4-trimethyl-1,2-dihydroquinoxaline is sourced from PubChem (CID 84621650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).