5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one

C18H15NO4 — CID 129051616

IUPAC5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one
SMILESCc1c2c(cc3c1OCC31C(=O)Nc3ccccc31)OCCO2
InChIInChI=1S/C18H15NO4/c1-10-15-12(8-14-16(10)22-7-6-21-14)18(9-23-15)11-4-2-3-5-13(11)19-17(18)20/h2-5,8H,6-7,9H2,1H3,(H,19,20)
InChIKeyJXRNURCACCRJQP-UHFFFAOYSA-N
MW309.32 g/mol
LogP2.40
Rot. Bonds

About 5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one

5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one (PubChem CID 129051616) has the molecular formula C18H15NO4 and a molecular weight of 309.32 g/mol. Its IUPAC name is 5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one.

Molecular Properties

Compound Name5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one
PubChem CID129051616
Molecular FormulaC18H15NO4
Molecular Weight309.32 g/mol
Exact Mass309.10
IUPAC Name5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one
SMILESCc1c2c(cc3c1OCC31C(=O)Nc3ccccc31)OCCO2
InChIInChI=1S/C18H15NO4/c1-10-15-12(8-14-16(10)22-7-6-21-14)18(9-23-15)11-4-2-3-5-13(11)19-17(18)20/h2-5,8H,6-7,9H2,1H3,(H,19,20)
InChIKeyJXRNURCACCRJQP-UHFFFAOYSA-N
XLogP2.40
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.32
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-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

Related Compounds

spiro[1H-indole-3,9'-2,3,7,8-tetrahydropyrano[2,3-g][1,4]benzodioxine]-2-one
CID 123384679
spiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one
CID 59263354
7'-methoxyspiro[1H-indole-3,3'-2H-furo[3,2-b]pyridine]-2-one
CID 68708060
4-tert-butylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one
CID 160500443
spiro[1H-indole-3,3'-2,7-dihydrofuro[3,2-g]chromene]-2-one
CID 67356579
spiro[1H-indole-3,3'-2,5-dihydrofuro[3,2-g]chromene]-2-one
CID 67356581
spiro[1H-indole-3,8'-3,7-dihydro-2H-furo[3,2-h][1,4]benzodioxine]-2-one
CID 90146106
5'-piperidin-3-ylspiro[1H-indole-3,3'-2H-1-benzofuran]-2-one
CID 66642723
1-(5-chloro-6-methyl-2,3-dihydro-1,4-benzodioxin-7-yl)cyclopropan-1-amine
CID 84799992
1,4-dioxane;(8R)-1'-methylspiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-2'-one
CID 143977132
(3R)-3-[(2E)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxyiminoethyl]-3-hydroxy-1H-indol-2-one
CID 5412583
5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one
CID 59352505

Frequently Asked Questions

What is the IUPAC name of 5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one?
The IUPAC name of 5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one (CID 129051616) is 5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one.
What is the SMILES notation for 5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one?
The canonical SMILES for 5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one is Cc1c2c(cc3c1OCC31C(=O)Nc3ccccc31)OCCO2.
What is the InChIKey of 5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one?
The InChIKey is JXRNURCACCRJQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO4/c1-10-15-12(8-14-16(10)22-7-6-21-14)18(9-23-15)11-4-2-3-5-13(11)19-17(18)20/h2-5,8H,6-7,9H2,1H3,(H,19,20).
What are the key properties of 5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one?
5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one has a molecular weight of 309.32 g/mol, XLogP of 2.40, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5'-methylspiro[1H-indole-3,8'-3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine]-2-one is sourced from PubChem (CID 129051616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).