2-propan-2-yl-1,8a-dihydroquinoxaline

C11H14N2 — CID 88995422

IUPAC2-propan-2-yl-1,8a-dihydroquinoxaline
SMILESCC(C)C1=CN=C2C=CC=CC2N1
InChIInChI=1S/C11H14N2/c1-8(2)11-7-12-9-5-3-4-6-10(9)13-11/h3-8,10,13H,1-2H3
InChIKeyWYESJRIREMXQPU-UHFFFAOYSA-N
MW174.25 g/mol
LogP2.02
Rot. Bonds1

About 2-propan-2-yl-1,8a-dihydroquinoxaline

2-propan-2-yl-1,8a-dihydroquinoxaline (PubChem CID 88995422) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is 2-propan-2-yl-1,8a-dihydroquinoxaline.

Molecular Properties

Compound Name2-propan-2-yl-1,8a-dihydroquinoxaline
PubChem CID88995422
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name2-propan-2-yl-1,8a-dihydroquinoxaline
SMILESCC(C)C1=CN=C2C=CC=CC2N1
InChIInChI=1S/C11H14N2/c1-8(2)11-7-12-9-5-3-4-6-10(9)13-11/h3-8,10,13H,1-2H3
InChIKeyWYESJRIREMXQPU-UHFFFAOYSA-N
XLogP2.02
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-propan-2-yl-1,8a-dihydroquinoxaline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Dihydropyrroloisoquinoline
CID 66919674
6,7-Difluoro-2,3-dimethyl-1,8a-dihydroquinoxaline
CID 147138512
6,7-Difluoro-2-methyl-1,8a-dihydroquinoxaline
CID 154554858
4,5-dimethyl-10a,11-dihydro-4aH-pyrido[4,3-a]carbazole
CID 172019445
1,8a-Dihydroquinoxaline
CID 21990073
1,4,5,5a-Tetrahydrophenazine
CID 23504326
5-Methyl-6,8a-dihydro-1,6-naphthyridine
CID 67593832
N,3-dimethyl-4-methyliminocyclohexa-1,5-dien-1-amine
CID 67679348
7,8,9,10-tetrahydro-4H-pyrazino[2,3-h][3]benzazepine
CID 68558757
1,2-Dihydropyrido[2,3-c][1]benzazocine
CID 69292210
2-(4-Methylcyclohexa-1,3-dien-1-yl)-1,8a-dihydroquinoxaline
CID 70815934
2-(1,2-Dihydropyridin-6-yl)-3,4-dihydropyridine
CID 89050135

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-1,8a-dihydroquinoxaline?
The IUPAC name of 2-propan-2-yl-1,8a-dihydroquinoxaline (CID 88995422) is 2-propan-2-yl-1,8a-dihydroquinoxaline.
What is the SMILES notation for 2-propan-2-yl-1,8a-dihydroquinoxaline?
The canonical SMILES for 2-propan-2-yl-1,8a-dihydroquinoxaline is CC(C)C1=CN=C2C=CC=CC2N1.
What is the InChIKey of 2-propan-2-yl-1,8a-dihydroquinoxaline?
The InChIKey is WYESJRIREMXQPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-8(2)11-7-12-9-5-3-4-6-10(9)13-11/h3-8,10,13H,1-2H3.
What are the key properties of 2-propan-2-yl-1,8a-dihydroquinoxaline?
2-propan-2-yl-1,8a-dihydroquinoxaline has a molecular weight of 174.25 g/mol, XLogP of 2.02, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-1,8a-dihydroquinoxaline is sourced from PubChem (CID 88995422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).