N-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide

C25H19FN2O5 — CID 59352416

IUPACN-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide
SMILESO=C(CN1C(=O)C2(COc3cc4c(cc32)OCCO4)c2ccccc21)Nc1ccccc1F
InChIInChI=1S/C25H19FN2O5/c26-17-6-2-3-7-18(17)27-23(29)13-28-19-8-4-1-5-15(19)25(24(28)30)14-33-20-12-22-21(11-16(20)25)31-9-10-32-22/h1-8,11-12H,9-10,13-14H2,(H,27,29)
InChIKeyCORWMPKOYZYVFJ-UHFFFAOYSA-N
MW446.43 g/mol
LogP3.26
Rot. Bonds3

About N-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide

N-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide (PubChem CID 59352416) has the molecular formula C25H19FN2O5 and a molecular weight of 446.43 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide
PubChem CID59352416
Molecular FormulaC25H19FN2O5
Molecular Weight446.43 g/mol
Exact Mass446.13
IUPAC NameN-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide
SMILESO=C(CN1C(=O)C2(COc3cc4c(cc32)OCCO4)c2ccccc21)Nc1ccccc1F
InChIInChI=1S/C25H19FN2O5/c26-17-6-2-3-7-18(17)27-23(29)13-28-19-8-4-1-5-15(19)25(24(28)30)14-33-20-12-22-21(11-16(20)25)31-9-10-32-22/h1-8,11-12H,9-10,13-14H2,(H,27,29)
InChIKeyCORWMPKOYZYVFJ-UHFFFAOYSA-N
XLogP3.26
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.43
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide 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

Xen-907
CID 11998198
2'-(2,4,5-trimethoxyphenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one
CID 49652040
(R)-1'-{[5-(trifluoromethyl)furan-2-yl]methyl}-2,3-dihydrospiro[furo[2,3-g][1,4]benzodioxine-8,3'-indol]-2'(1'H)-one
CID 51352118
1'-[(4-fluorophenyl)methyl]-6,7,8-trimethoxyspiro[3,4-dihydro-2H-isoquinoline-1,3'-indole]-2'-one
CID 155102186
(7~{R})-1'-pentylspiro[6~{H}-furo[3,2-f][1,3]benzodioxole-7,3'-indole]-2'-one
CID 95235182
1-(4-fluorophenyl)-3-[2-(2'-oxospiro[furo[2,3-f][1,3]benzodioxole-7,3'-indol]-1'(2'H)-yl)ethyl]urea
CID 11998070
N-(2-fluoro-5-methylphenyl)-2-(2'-oxospiro[6H-furo[2,3-f][1,3]benzodioxole-7,3'-indole]-1'-yl)acetamide
CID 11998340
N-(2-fluorophenyl)-2-(2'-oxospiro[5,6-dihydro-2H-furo[3,2-f][1]benzofuran-3,3'-indole]-1'-yl)acetamide
CID 11998584
4'-[3,5-bis(trifluoromethyl)phenyl]-1'-pentylspiro[6H-furo[2,3-f][1,3]benzodioxole-7,3'-indole]-2'-one
CID 11998587
4'-[(E)-2-(4-fluorophenyl)ethenyl]-1'-pentylspiro[6H-furo[2,3-f][1,3]benzodioxole-7,3'-indole]-2'-one
CID 11998706
2-[(2'-oxospiro[6H-furo[2,3-f][1,3]benzodioxole-7,3'-indole]-1'-yl)methyl]-N-[2-(trifluoromethyl)phenyl]benzamide
CID 11999169
N-(3,5-difluorophenyl)-2-[(2'-oxospiro[6H-furo[2,3-f][1,3]benzodioxole-7,3'-indole]-1'-yl)methyl]benzamide
CID 11999170

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide?
The IUPAC name of N-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide (CID 59352416) is N-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide?
The canonical SMILES for N-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide is O=C(CN1C(=O)C2(COc3cc4c(cc32)OCCO4)c2ccccc21)Nc1ccccc1F.
What is the InChIKey of N-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide?
The InChIKey is CORWMPKOYZYVFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19FN2O5/c26-17-6-2-3-7-18(17)27-23(29)13-28-19-8-4-1-5-15(19)25(24(28)30)14-33-20-12-22-21(11-16(20)25)31-9-10-32-22/h1-8,11-12H,9-10,13-14H2,(H,27,29).
What are the key properties of N-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide?
N-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide has a molecular weight of 446.43 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-(2'-oxospiro[3,7-dihydro-2H-furo[2,3-g][1,4]benzodioxine-8,3'-indole]-1'-yl)acetamide is sourced from PubChem (CID 59352416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).