2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline

C10H14N2 — CID 22091312

IUPAC2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline
SMILESCc1nc2c(nc1C)CCCC2
InChIInChI=1S/C10H14N2/c1-7-8(2)12-10-6-4-3-5-9(10)11-7/h3-6H2,1-2H3
InChIKeyHBCWUELMHBWORT-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.97
Rot. Bonds

About 2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline

2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline (PubChem CID 22091312) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline.

Molecular Properties

Compound Name2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline
PubChem CID22091312
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline
SMILESCc1nc2c(nc1C)CCCC2
InChIInChI=1S/C10H14N2/c1-7-8(2)12-10-6-4-3-5-9(10)11-7/h3-6H2,1-2H3
InChIKeyHBCWUELMHBWORT-UHFFFAOYSA-N
XLogP1.97
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline?
The IUPAC name of 2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline (CID 22091312) is 2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline.
What is the SMILES notation for 2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline?
The canonical SMILES for 2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline is Cc1nc2c(nc1C)CCCC2.
What is the InChIKey of 2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline?
The InChIKey is HBCWUELMHBWORT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-7-8(2)12-10-6-4-3-5-9(10)11-7/h3-6H2,1-2H3.
What are the key properties of 2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline?
2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline has a molecular weight of 162.24 g/mol, XLogP of 1.97, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-5,6,7,8-tetrahydroquinoxaline is sourced from PubChem (CID 22091312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).