5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one

C19H15N3O — CID 127026177

IUPAC5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one
SMILESCc1ccc2c(c1)C1(Nc3ccccc3-n3cccc31)C(=O)N2
InChIInChI=1S/C19H15N3O/c1-12-8-9-14-13(11-12)19(18(23)20-14)17-7-4-10-22(17)16-6-3-2-5-15(16)21-19/h2-11,21H,1H3,(H,20,23)
InChIKeyRUXYJAFUTQVCLL-UHFFFAOYSA-N
MW301.35 g/mol
LogP3.41
Rot. Bonds

About 5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one

5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one (PubChem CID 127026177) has the molecular formula C19H15N3O and a molecular weight of 301.35 g/mol. Its IUPAC name is 5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one.

Molecular Properties

Compound Name5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one
PubChem CID127026177
Molecular FormulaC19H15N3O
Molecular Weight301.35 g/mol
Exact Mass301.12
IUPAC Name5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one
SMILESCc1ccc2c(c1)C1(Nc3ccccc3-n3cccc31)C(=O)N2
InChIInChI=1S/C19H15N3O/c1-12-8-9-14-13(11-12)19(18(23)20-14)17-7-4-10-22(17)16-6-3-2-5-15(16)21-19/h2-11,21H,1H3,(H,20,23)
InChIKeyRUXYJAFUTQVCLL-UHFFFAOYSA-N
XLogP3.41
TPSA46.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one?
The IUPAC name of 5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one (CID 127026177) is 5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one.
What is the SMILES notation for 5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one?
The canonical SMILES for 5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one is Cc1ccc2c(c1)C1(Nc3ccccc3-n3cccc31)C(=O)N2.
What is the InChIKey of 5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one?
The InChIKey is RUXYJAFUTQVCLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O/c1-12-8-9-14-13(11-12)19(18(23)20-14)17-7-4-10-22(17)16-6-3-2-5-15(16)21-19/h2-11,21H,1H3,(H,20,23).
What are the key properties of 5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one?
5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one has a molecular weight of 301.35 g/mol, XLogP of 3.41, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylspiro[1H-indole-3,4'-5H-pyrrolo[1,2-a]quinoxaline]-2-one is sourced from PubChem (CID 127026177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).