9-prop-2-enoxyfuro[3,2-g]chromen-7-one

C14H10O4 — CID 12772891

IUPAC9-prop-2-enoxyfuro[3,2-g]chromen-7-one
SMILESC=CCOc1c2occc2cc2ccc(=O)oc12
InChIInChI=1S/C14H10O4/c1-2-6-16-14-12-10(5-7-17-12)8-9-3-4-11(15)18-13(9)14/h2-5,7-8H,1,6H2
InChIKeyNSKDBUBAOLSDRF-UHFFFAOYSA-N
MW242.23 g/mol
LogP3.10
Rot. Bonds3

About 9-prop-2-enoxyfuro[3,2-g]chromen-7-one

9-prop-2-enoxyfuro[3,2-g]chromen-7-one (PubChem CID 12772891) has the molecular formula C14H10O4 and a molecular weight of 242.23 g/mol. Its IUPAC name is 9-prop-2-enoxyfuro[3,2-g]chromen-7-one.

Molecular Properties

Compound Name9-prop-2-enoxyfuro[3,2-g]chromen-7-one
PubChem CID12772891
Molecular FormulaC14H10O4
Molecular Weight242.23 g/mol
Exact Mass242.06
IUPAC Name9-prop-2-enoxyfuro[3,2-g]chromen-7-one
SMILESC=CCOc1c2occc2cc2ccc(=O)oc12
InChIInChI=1S/C14H10O4/c1-2-6-16-14-12-10(5-7-17-12)8-9-3-4-11(15)18-13(9)14/h2-5,7-8H,1,6H2
InChIKeyNSKDBUBAOLSDRF-UHFFFAOYSA-N
XLogP3.10
TPSA52.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.23
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 9-prop-2-enoxyfuro[3,2-g]chromen-7-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 9-prop-2-enoxyfuro[3,2-g]chromen-7-one?
The IUPAC name of 9-prop-2-enoxyfuro[3,2-g]chromen-7-one (CID 12772891) is 9-prop-2-enoxyfuro[3,2-g]chromen-7-one.
What is the SMILES notation for 9-prop-2-enoxyfuro[3,2-g]chromen-7-one?
The canonical SMILES for 9-prop-2-enoxyfuro[3,2-g]chromen-7-one is C=CCOc1c2occc2cc2ccc(=O)oc12.
What is the InChIKey of 9-prop-2-enoxyfuro[3,2-g]chromen-7-one?
The InChIKey is NSKDBUBAOLSDRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10O4/c1-2-6-16-14-12-10(5-7-17-12)8-9-3-4-11(15)18-13(9)14/h2-5,7-8H,1,6H2.
What are the key properties of 9-prop-2-enoxyfuro[3,2-g]chromen-7-one?
9-prop-2-enoxyfuro[3,2-g]chromen-7-one has a molecular weight of 242.23 g/mol, XLogP of 3.10, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-prop-2-enoxyfuro[3,2-g]chromen-7-one is sourced from PubChem (CID 12772891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).