2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride

C11H17ClN2 — CID 134691155

IUPAC2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride
SMILESCN1CC(C)(C)Nc2ccccc21.Cl
InChIInChI=1S/C11H16N2.ClH/c1-11(2)8-13(3)10-7-5-4-6-9(10)12-11;/h4-7,12H,8H2,1-3H3;1H
InChIKeyGQJANNRLRAFIFX-UHFFFAOYSA-N
MW212.72 g/mol
LogP2.75
Rot. Bonds

About 2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride

2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride (PubChem CID 134691155) has the molecular formula C11H17ClN2 and a molecular weight of 212.72 g/mol. Its IUPAC name is 2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride.

Molecular Properties

Compound Name2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride
PubChem CID134691155
Molecular FormulaC11H17ClN2
Molecular Weight212.72 g/mol
Exact Mass212.11
IUPAC Name2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride
SMILESCN1CC(C)(C)Nc2ccccc21.Cl
InChIInChI=1S/C11H16N2.ClH/c1-11(2)8-13(3)10-7-5-4-6-9(10)12-11;/h4-7,12H,8H2,1-3H3;1H
InChIKeyGQJANNRLRAFIFX-UHFFFAOYSA-N
XLogP2.75
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.72
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride?
The IUPAC name of 2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride (CID 134691155) is 2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride.
What is the SMILES notation for 2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride?
The canonical SMILES for 2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride is CN1CC(C)(C)Nc2ccccc21.Cl.
What is the InChIKey of 2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride?
The InChIKey is GQJANNRLRAFIFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2.ClH/c1-11(2)8-13(3)10-7-5-4-6-9(10)12-11;/h4-7,12H,8H2,1-3H3;1H.
What are the key properties of 2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride?
2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride has a molecular weight of 212.72 g/mol, XLogP of 2.75, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4-trimethyl-1,3-dihydroquinoxaline;hydrochloride is sourced from PubChem (CID 134691155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).