11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline

C24H18N2O — CID 6612151

IUPAC11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline
SMILESCOc1ccc(C=C2c3cc(C)ccc3-c3nc4ccccc4nc32)cc1
InChIInChI=1S/C24H18N2O/c1-15-7-12-18-19(13-15)20(14-16-8-10-17(27-2)11-9-16)24-23(18)25-21-5-3-4-6-22(21)26-24/h3-14H,1-2H3
InChIKeyPGPSXBCUCMQPAI-UHFFFAOYSA-N
MW350.42 g/mol
LogP5.52
Rot. Bonds2

About 11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline

11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline (PubChem CID 6612151) has the molecular formula C24H18N2O and a molecular weight of 350.42 g/mol. Its IUPAC name is 11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline.

Molecular Properties

Compound Name11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline
PubChem CID6612151
Molecular FormulaC24H18N2O
Molecular Weight350.42 g/mol
Exact Mass350.14
IUPAC Name11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline
SMILESCOc1ccc(C=C2c3cc(C)ccc3-c3nc4ccccc4nc32)cc1
InChIInChI=1S/C24H18N2O/c1-15-7-12-18-19(13-15)20(14-16-8-10-17(27-2)11-9-16)24-23(18)25-21-5-3-4-6-22(21)26-24/h3-14H,1-2H3
InChIKeyPGPSXBCUCMQPAI-UHFFFAOYSA-N
XLogP5.52
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.42
LogP ≤ 55.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline?
The IUPAC name of 11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline (CID 6612151) is 11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline.
What is the SMILES notation for 11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline?
The canonical SMILES for 11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline is COc1ccc(C=C2c3cc(C)ccc3-c3nc4ccccc4nc32)cc1.
What is the InChIKey of 11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline?
The InChIKey is PGPSXBCUCMQPAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N2O/c1-15-7-12-18-19(13-15)20(14-16-8-10-17(27-2)11-9-16)24-23(18)25-21-5-3-4-6-22(21)26-24/h3-14H,1-2H3.
What are the key properties of 11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline?
11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline has a molecular weight of 350.42 g/mol, XLogP of 5.52, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[(4-methoxyphenyl)methylidene]-2-methylindeno[1,2-b]quinoxaline is sourced from PubChem (CID 6612151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).