3a'-(4-Fluorophenyl)dihydrodispiro[cyclopentane-1,3'-furo[3,2-b]furan-6',1''-cyclopentane]-2',5'-dione

C20H21FO4 — CID 2940957

IUPAC—
SMILESO=C1OC2(c3ccc(F)cc3)C(OC(=O)C23CCCC3)C12CCCC2
InChIInChI=1S/C20H21FO4/c21-14-7-5-13(6-8-14)20-15(18(16(22)25-20)9-1-2-10-18)24-17(23)19(20)11-3-4-12-19/h5-8,15H,1-4,9-12H2
InChIKeyPHGYMSVEXAWLCS-UHFFFAOYSA-N
MW344.38 g/mol
LogP3.62
Rot. Bonds1

About 3a'-(4-Fluorophenyl)dihydrodispiro[cyclopentane-1,3'-furo[3,2-b]furan-6',1''-cyclopentane]-2',5'-dione

3a'-(4-Fluorophenyl)dihydrodispiro[cyclopentane-1,3'-furo[3,2-b]furan-6',1''-cyclopentane]-2',5'-dione (PubChem CID 2940957) has the molecular formula C20H21FO4 and a molecular weight of 344.38 g/mol.

Molecular Properties

Compound Name3a'-(4-Fluorophenyl)dihydrodispiro[cyclopentane-1,3'-furo[3,2-b]furan-6',1''-cyclopentane]-2',5'-dione
PubChem CID2940957
Molecular FormulaC20H21FO4
Molecular Weight344.38 g/mol
Exact Mass344.14
IUPAC Name—
SMILESO=C1OC2(c3ccc(F)cc3)C(OC(=O)C23CCCC3)C12CCCC2
InChIInChI=1S/C20H21FO4/c21-14-7-5-13(6-8-14)20-15(18(16(22)25-20)9-1-2-10-18)24-17(23)19(20)11-3-4-12-19/h5-8,15H,1-4,9-12H2
InChIKeyPHGYMSVEXAWLCS-UHFFFAOYSA-N
XLogP3.62
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.38
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3a'-(4-Fluorophenyl)dihydrodispiro[cyclopentane-1,3'-furo[3,2-b]furan-6',1''-cyclopentane]-2',5'-dione 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 3a'-(4-Fluorophenyl)dihydrodispiro[cyclopentane-1,3'-furo[3,2-b]furan-6',1''-cyclopentane]-2',5'-dione?
The IUPAC name of 3a'-(4-Fluorophenyl)dihydrodispiro[cyclopentane-1,3'-furo[3,2-b]furan-6',1''-cyclopentane]-2',5'-dione (CID 2940957) is not available.
What is the SMILES notation for 3a'-(4-Fluorophenyl)dihydrodispiro[cyclopentane-1,3'-furo[3,2-b]furan-6',1''-cyclopentane]-2',5'-dione?
The canonical SMILES for 3a'-(4-Fluorophenyl)dihydrodispiro[cyclopentane-1,3'-furo[3,2-b]furan-6',1''-cyclopentane]-2',5'-dione is O=C1OC2(c3ccc(F)cc3)C(OC(=O)C23CCCC3)C12CCCC2.
What is the InChIKey of 3a'-(4-Fluorophenyl)dihydrodispiro[cyclopentane-1,3'-furo[3,2-b]furan-6',1''-cyclopentane]-2',5'-dione?
The InChIKey is PHGYMSVEXAWLCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FO4/c21-14-7-5-13(6-8-14)20-15(18(16(22)25-20)9-1-2-10-18)24-17(23)19(20)11-3-4-12-19/h5-8,15H,1-4,9-12H2.
What are the key properties of 3a'-(4-Fluorophenyl)dihydrodispiro[cyclopentane-1,3'-furo[3,2-b]furan-6',1''-cyclopentane]-2',5'-dione?
3a'-(4-Fluorophenyl)dihydrodispiro[cyclopentane-1,3'-furo[3,2-b]furan-6',1''-cyclopentane]-2',5'-dione has a molecular weight of 344.38 g/mol, XLogP of 3.62, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3a'-(4-Fluorophenyl)dihydrodispiro[cyclopentane-1,3'-furo[3,2-b]furan-6',1''-cyclopentane]-2',5'-dione is sourced from PubChem (CID 2940957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).