6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline

C12H17FN2 — CID 115095185

IUPAC6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline
SMILESCC1CN(C(C)C)c2cc(F)ccc2N1
InChIInChI=1S/C12H17FN2/c1-8(2)15-7-9(3)14-11-5-4-10(13)6-12(11)15/h4-6,8-9,14H,7H2,1-3H3
InChIKeyRLSFGYRWWMSOEW-UHFFFAOYSA-N
MW208.28 g/mol
LogP2.85
Rot. Bonds1

About 6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline

6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline (PubChem CID 115095185) has the molecular formula C12H17FN2 and a molecular weight of 208.28 g/mol. Its IUPAC name is 6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline.

Molecular Properties

Compound Name6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline
PubChem CID115095185
Molecular FormulaC12H17FN2
Molecular Weight208.28 g/mol
Exact Mass208.14
IUPAC Name6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline
SMILESCC1CN(C(C)C)c2cc(F)ccc2N1
InChIInChI=1S/C12H17FN2/c1-8(2)15-7-9(3)14-11-5-4-10(13)6-12(11)15/h4-6,8-9,14H,7H2,1-3H3
InChIKeyRLSFGYRWWMSOEW-UHFFFAOYSA-N
XLogP2.85
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline with MolForge

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Launch Full Analysis

Related Compounds

4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline
CID 115095182
8-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline
CID 115094853
2-ethyl-6-fluoro-4-methyl-2,3-dihydro-1H-quinoxaline
CID 84619292
(5-fluoro-1-propan-2-yl-2,3-dihydroindol-3-yl)methanamine
CID 83861224
(2R)-7-fluoro-2-methyl-1-propan-2-yl-3,4-dihydro-2H-quinoline
CID 163270361
6-fluoro-4-methyl-1-propan-2-yl-2,3-dihydroquinoxaline
CID 166553115
1-(5-fluoro-1-propan-2-yl-2,3-dihydroindol-3-yl)propan-2-amine
CID 115006256
7-fluoro-1,4-dimethyl-4,5-dihydro-3H-1,5-benzodiazepin-2-one
CID 84621066
6-fluoro-4-propan-2-ylspiro[1H-quinoxaline-3,1'-cyclopropane]-2-one
CID 115097176
5-fluoro-2-propan-2-yl-2,3-dihydro-1H-indole
CID 82276851
1-(2,4-difluorophenyl)-5-methyl-2-propan-2-ylpiperazine
CID 64954077
2,4-dimethyl-2,3-dihydro-1H-quinoxaline;ethane
CID 156796613

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline?
The IUPAC name of 6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline (CID 115095185) is 6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline.
What is the SMILES notation for 6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline?
The canonical SMILES for 6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline is CC1CN(C(C)C)c2cc(F)ccc2N1.
What is the InChIKey of 6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline?
The InChIKey is RLSFGYRWWMSOEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2/c1-8(2)15-7-9(3)14-11-5-4-10(13)6-12(11)15/h4-6,8-9,14H,7H2,1-3H3.
What are the key properties of 6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline?
6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline has a molecular weight of 208.28 g/mol, XLogP of 2.85, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-methyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline is sourced from PubChem (CID 115095185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).