2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone

C16H13FO — CID 43338936

IUPAC2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone
SMILESO=C(c1ccc2c(c1)CCC2)c1ccccc1F
InChIInChI=1S/C16H13FO/c17-15-7-2-1-6-14(15)16(18)13-9-8-11-4-3-5-12(11)10-13/h1-2,6-10H,3-5H2
InChIKeyBEWGSUNHOMPILF-UHFFFAOYSA-N
MW240.28 g/mol
LogP3.55
Rot. Bonds2

About 2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone

2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone (PubChem CID 43338936) has the molecular formula C16H13FO and a molecular weight of 240.28 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone
PubChem CID43338936
Molecular FormulaC16H13FO
Molecular Weight240.28 g/mol
Exact Mass240.10
IUPAC Name2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone
SMILESO=C(c1ccc2c(c1)CCC2)c1ccccc1F
InChIInChI=1S/C16H13FO/c17-15-7-2-1-6-14(15)16(18)13-9-8-11-4-3-5-12(11)10-13/h1-2,6-10H,3-5H2
InChIKeyBEWGSUNHOMPILF-UHFFFAOYSA-N
XLogP3.55
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.28
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone 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 2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone?
The IUPAC name of 2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone (CID 43338936) is 2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone.
What is the SMILES notation for 2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone?
The canonical SMILES for 2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone is O=C(c1ccc2c(c1)CCC2)c1ccccc1F.
What is the InChIKey of 2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone?
The InChIKey is BEWGSUNHOMPILF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FO/c17-15-7-2-1-6-14(15)16(18)13-9-8-11-4-3-5-12(11)10-13/h1-2,6-10H,3-5H2.
What are the key properties of 2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone?
2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone has a molecular weight of 240.28 g/mol, XLogP of 3.55, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone is sourced from PubChem (CID 43338936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).