6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline

C13H20N2 — CID 84620438

IUPAC6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline
SMILESCCc1ccc2c(c1)N(C)CC(C)(C)N2
InChIInChI=1S/C13H20N2/c1-5-10-6-7-11-12(8-10)15(4)9-13(2,3)14-11/h6-8,14H,5,9H2,1-4H3
InChIKeyKPQYCLUVEDSMCC-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.89
Rot. Bonds1

About 6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline

6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline (PubChem CID 84620438) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline.

Molecular Properties

Compound Name6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline
PubChem CID84620438
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline
SMILESCCc1ccc2c(c1)N(C)CC(C)(C)N2
InChIInChI=1S/C13H20N2/c1-5-10-6-7-11-12(8-10)15(4)9-13(2,3)14-11/h6-8,14H,5,9H2,1-4H3
InChIKeyKPQYCLUVEDSMCC-UHFFFAOYSA-N
XLogP2.89
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride
CID 134691155
7-ethyl-3,3-dimethyl-2,4-dihydro-1,4-benzoxazine
CID 90392310
(4S)-6-ethyl-2,2,4-trimethyl-3,4-dihydro-1H-quinoline
CID 7823786
4-ethyl-2,2-dimethyl-1,3-dihydroquinoxalin-6-ol
CID 115095246
(1-ethyl-3,3-dimethyl-2,4-dihydroquinoxalin-6-yl)methanamine
CID 115096393
3,5-diethyl-3-methyl-1,2-dihydroindole
CID 165441920
2,2-dimethyl-4-propan-2-yl-1,3-dihydroquinoxalin-6-amine
CID 115096246
7-(hydroxymethyl)-1,3,3-trimethyl-4H-quinoxalin-2-one
CID 115096207
7-ethyl-5-methyl-4H-1,3,5-benzodioxazepine
CID 143588706
7-(5-ethyl-2-methylphenyl)-2-methyl-2,7-diazaspiro[3.5]nonane
CID 167015494
7-ethyl-N-methyl-1,2,3,4-tetrahydro-1,5-benzodiazepin-5-amine
CID 154958360
1,6-diethyl-4-methyl-3H-quinoxalin-2-one
CID 155066650

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline?
The IUPAC name of 6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline (CID 84620438) is 6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline.
What is the SMILES notation for 6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline?
The canonical SMILES for 6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline is CCc1ccc2c(c1)N(C)CC(C)(C)N2.
What is the InChIKey of 6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline?
The InChIKey is KPQYCLUVEDSMCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-5-10-6-7-11-12(8-10)15(4)9-13(2,3)14-11/h6-8,14H,5,9H2,1-4H3.
What are the key properties of 6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline?
6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline has a molecular weight of 204.32 g/mol, XLogP of 2.89, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2,2,4-trimethyl-1,3-dihydroquinoxaline is sourced from PubChem (CID 84620438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).