4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline

C12H18N2 — CID 82156538

IUPAC4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline
SMILESCCN1CCNc2cc(C)c(C)cc21
InChIInChI=1S/C12H18N2/c1-4-14-6-5-13-11-7-9(2)10(3)8-12(11)14/h7-8,13H,4-6H2,1-3H3
InChIKeyJCJPQOSZUWAUQW-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.56
Rot. Bonds1

About 4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline

4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline (PubChem CID 82156538) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline.

Molecular Properties

Compound Name4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline
PubChem CID82156538
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline
SMILESCCN1CCNc2cc(C)c(C)cc21
InChIInChI=1S/C12H18N2/c1-4-14-6-5-13-11-7-9(2)10(3)8-12(11)14/h7-8,13H,4-6H2,1-3H3
InChIKeyJCJPQOSZUWAUQW-UHFFFAOYSA-N
XLogP2.56
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline?
The IUPAC name of 4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline (CID 82156538) is 4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline.
What is the SMILES notation for 4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline?
The canonical SMILES for 4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline is CCN1CCNc2cc(C)c(C)cc21.
What is the InChIKey of 4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline?
The InChIKey is JCJPQOSZUWAUQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-4-14-6-5-13-11-7-9(2)10(3)8-12(11)14/h7-8,13H,4-6H2,1-3H3.
What are the key properties of 4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline?
4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline has a molecular weight of 190.29 g/mol, XLogP of 2.56, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6,7-dimethyl-2,3-dihydro-1H-quinoxaline is sourced from PubChem (CID 82156538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).