6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline

C12H17ClN2 — CID 84624811

IUPAC6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline
SMILESCCC1CN(C)c2cc(Cl)cc(C)c2N1
InChIInChI=1S/C12H17ClN2/c1-4-10-7-15(3)11-6-9(13)5-8(2)12(11)14-10/h5-6,10,14H,4,7H2,1-3H3
InChIKeyLJZUJNAGDZDJAM-UHFFFAOYSA-N
MW224.73 g/mol
LogP3.29
Rot. Bonds1

About 6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline

6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline (PubChem CID 84624811) has the molecular formula C12H17ClN2 and a molecular weight of 224.73 g/mol. Its IUPAC name is 6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline.

Molecular Properties

Compound Name6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline
PubChem CID84624811
Molecular FormulaC12H17ClN2
Molecular Weight224.73 g/mol
Exact Mass224.11
IUPAC Name6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline
SMILESCCC1CN(C)c2cc(Cl)cc(C)c2N1
InChIInChI=1S/C12H17ClN2/c1-4-10-7-15(3)11-6-9(13)5-8(2)12(11)14-10/h5-6,10,14H,4,7H2,1-3H3
InChIKeyLJZUJNAGDZDJAM-UHFFFAOYSA-N
XLogP3.29
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.73
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline with MolForge

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Related Compounds

7-chloro-2-ethyl-4,5-dimethyl-2,3-dihydro-1H-quinoxaline
CID 84624812
2-ethyl-6-fluoro-4-methyl-2,3-dihydro-1H-quinoxaline
CID 84619292
2-ethyl-4-methyl-6-propan-2-yl-2,3-dihydro-1H-quinoxaline
CID 84623191
1-(4-chloro-2-methylphenyl)-3-ethyl-1,4-diazepane
CID 114256615
2,4,8-trimethyl-2,3-dihydro-1H-quinoxaline
CID 84618404
9-chloro-6-ethyl-7-methyl-1,2,3,4,4a,5-hexahydropyrazino[1,2-a]quinoxaline
CID 84640120
2,5-diethyl-4-methyl-2,3-dihydro-1H-quinoxaline
CID 84620474
2-(5,7-dichloro-1-methyl-3,4-dihydro-2H-quinolin-3-yl)acetic acid
CID 82626082
(10R)-10-ethyl-5-methyl-2-(2,3,5-trichlorophenyl)-1,3,5,7,9-pentazatricyclo[6.3.1.04,12]dodeca-2,4(12),7-trien-6-one
CID 135512058
(4-chloro-2-methylphenyl)-[(3S)-3-ethylpiperazin-1-yl]methanone
CID 95210383
5-chloro-2-cyclopentyl-7-methyl-2,3-dihydro-1H-indole
CID 3950781
1-(7-chloro-2,2,5-trimethyl-3,4-dihydroquinoxalin-1-yl)ethanone
CID 84634803

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline?
The IUPAC name of 6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline (CID 84624811) is 6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline.
What is the SMILES notation for 6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline?
The canonical SMILES for 6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline is CCC1CN(C)c2cc(Cl)cc(C)c2N1.
What is the InChIKey of 6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline?
The InChIKey is LJZUJNAGDZDJAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2/c1-4-10-7-15(3)11-6-9(13)5-8(2)12(11)14-10/h5-6,10,14H,4,7H2,1-3H3.
What are the key properties of 6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline?
6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline has a molecular weight of 224.73 g/mol, XLogP of 3.29, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-ethyl-4,8-dimethyl-2,3-dihydro-1H-quinoxaline is sourced from PubChem (CID 84624811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).