4-fluoro-7-methoxy-2,3-dihydro-1H-indene

C10H11FO — CID 23208941

IUPAC4-fluoro-7-methoxy-2,3-dihydro-1H-indene
SMILESCOc1ccc(F)c2c1CCC2
InChIInChI=1S/C10H11FO/c1-12-10-6-5-9(11)7-3-2-4-8(7)10/h5-6H,2-4H2,1H3
InChIKeyQDBXYKBDEOPVBD-UHFFFAOYSA-N
MW166.19 g/mol
LogP2.32
Rot. Bonds1

About 4-fluoro-7-methoxy-2,3-dihydro-1H-indene

4-fluoro-7-methoxy-2,3-dihydro-1H-indene (PubChem CID 23208941) has the molecular formula C10H11FO and a molecular weight of 166.19 g/mol. Its IUPAC name is 4-fluoro-7-methoxy-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name4-fluoro-7-methoxy-2,3-dihydro-1H-indene
PubChem CID23208941
Molecular FormulaC10H11FO
Molecular Weight166.19 g/mol
Exact Mass166.08
IUPAC Name4-fluoro-7-methoxy-2,3-dihydro-1H-indene
SMILESCOc1ccc(F)c2c1CCC2
InChIInChI=1S/C10H11FO/c1-12-10-6-5-9(11)7-3-2-4-8(7)10/h5-6H,2-4H2,1H3
InChIKeyQDBXYKBDEOPVBD-UHFFFAOYSA-N
XLogP2.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.19
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-7-methoxy-2,3-dihydro-1H-indene?
The IUPAC name of 4-fluoro-7-methoxy-2,3-dihydro-1H-indene (CID 23208941) is 4-fluoro-7-methoxy-2,3-dihydro-1H-indene.
What is the SMILES notation for 4-fluoro-7-methoxy-2,3-dihydro-1H-indene?
The canonical SMILES for 4-fluoro-7-methoxy-2,3-dihydro-1H-indene is COc1ccc(F)c2c1CCC2.
What is the InChIKey of 4-fluoro-7-methoxy-2,3-dihydro-1H-indene?
The InChIKey is QDBXYKBDEOPVBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO/c1-12-10-6-5-9(11)7-3-2-4-8(7)10/h5-6H,2-4H2,1H3.
What are the key properties of 4-fluoro-7-methoxy-2,3-dihydro-1H-indene?
4-fluoro-7-methoxy-2,3-dihydro-1H-indene has a molecular weight of 166.19 g/mol, XLogP of 2.32, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-7-methoxy-2,3-dihydro-1H-indene is sourced from PubChem (CID 23208941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).