6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one

C16H17FN2O3 — CID 69420324

IUPAC6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one
SMILESCOCCN(C)C1=CC(=C2C(=O)Nc3cc(F)ccc32)OC1
InChIInChI=1S/C16H17FN2O3/c1-19(5-6-21-2)11-8-14(22-9-11)15-12-4-3-10(17)7-13(12)18-16(15)20/h3-4,7-8H,5-6,9H2,1-2H3,(H,18,20)
InChIKeyYBAZFCRKJNKUFL-UHFFFAOYSA-N
MW304.32 g/mol
LogP1.98
Rot. Bonds4

About 6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one

6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one (PubChem CID 69420324) has the molecular formula C16H17FN2O3 and a molecular weight of 304.32 g/mol. Its IUPAC name is 6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one.

Molecular Properties

Compound Name6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one
PubChem CID69420324
Molecular FormulaC16H17FN2O3
Molecular Weight304.32 g/mol
Exact Mass304.12
IUPAC Name6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one
SMILESCOCCN(C)C1=CC(=C2C(=O)Nc3cc(F)ccc32)OC1
InChIInChI=1S/C16H17FN2O3/c1-19(5-6-21-2)11-8-14(22-9-11)15-12-4-3-10(17)7-13(12)18-16(15)20/h3-4,7-8H,5-6,9H2,1-2H3,(H,18,20)
InChIKeyYBAZFCRKJNKUFL-UHFFFAOYSA-N
XLogP1.98
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.32
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-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

CID 147616014
CID 147616014
(3E)-3-(3-bromo-2H-furan-5-ylidene)-6-fluoro-1H-indol-2-one
CID 58926075
6-fluoro-3-[4-[4-[[2-methoxyethyl(methyl)amino]methyl]phenyl]-5,5-dimethylfuran-2-ylidene]-1H-indol-2-one
CID 69451466
4-[(5E)-5-(6-fluoro-2-oxo-1H-indol-3-ylidene)-2,2-dimethylfuran-3-yl]-N-(2-methoxyethyl)-N-methylbenzamide
CID 58926418
3-[3-(1,3-benzodioxol-5-yl)-2H-furan-5-ylidene]-6-fluoro-1H-indol-2-one
CID 69449557
(3E)-3-[3-(1,3-benzodioxol-5-yl)-2H-furan-5-ylidene]-6-fluoro-1H-indol-2-one
CID 58926387
(3E)-3-[4-[2-[bis(2-methoxyethyl)amino]-4-pyridinyl]-5,5-dimethylfuran-2-ylidene]-6-fluoro-1H-indol-2-one
CID 58926028
(3E)-6-fluoro-3-[3-[4-[2-(2-hydroxyethoxy)ethyl]piperazin-1-yl]-2H-furan-5-ylidene]-1H-indol-2-one
CID 24964165
N-[4-[(5E)-5-(6-fluoro-2-oxo-1H-indol-3-ylidene)-2H-furan-3-yl]phenyl]methanesulfonamide
CID 58926088
(3E)-3-[3-(1-benzothiophen-3-yl)-2H-furan-5-ylidene]-6-fluoro-1H-indol-2-one
CID 58926121
(3E)-6-fluoro-3-[4-[4-(methoxymethyl)phenyl]-5,5-dimethylfuran-2-ylidene]-1H-indol-2-one
CID 58926361
CID 149362037
CID 149362037

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one?
The IUPAC name of 6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one (CID 69420324) is 6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one.
What is the SMILES notation for 6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one?
The canonical SMILES for 6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one is COCCN(C)C1=CC(=C2C(=O)Nc3cc(F)ccc32)OC1.
What is the InChIKey of 6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one?
The InChIKey is YBAZFCRKJNKUFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O3/c1-19(5-6-21-2)11-8-14(22-9-11)15-12-4-3-10(17)7-13(12)18-16(15)20/h3-4,7-8H,5-6,9H2,1-2H3,(H,18,20).
What are the key properties of 6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one?
6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one has a molecular weight of 304.32 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-[3-[2-methoxyethyl(methyl)amino]-2H-furan-5-ylidene]-1H-indol-2-one is sourced from PubChem (CID 69420324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).