2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone

C18H17FO — CID 106877016

IUPAC2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone
SMILESCc1cc(F)cc(C)c1C(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C18H17FO/c1-11-8-16(19)9-12(2)17(11)18(20)15-7-6-13-4-3-5-14(13)10-15/h6-10H,3-5H2,1-2H3
InChIKeyCFQWBIBFHOSYFG-UHFFFAOYSA-N
MW268.33 g/mol
LogP4.16
Rot. Bonds2

About 2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone

2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone (PubChem CID 106877016) has the molecular formula C18H17FO and a molecular weight of 268.33 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone
PubChem CID106877016
Molecular FormulaC18H17FO
Molecular Weight268.33 g/mol
Exact Mass268.13
IUPAC Name2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone
SMILESCc1cc(F)cc(C)c1C(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C18H17FO/c1-11-8-16(19)9-12(2)17(11)18(20)15-7-6-13-4-3-5-14(13)10-15/h6-10H,3-5H2,1-2H3
InChIKeyCFQWBIBFHOSYFG-UHFFFAOYSA-N
XLogP4.16
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.33
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone 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

2,3-dihydro-1H-inden-5-yl-(4-fluoro-2-methylphenyl)methanone
CID 113399939
2,3-dihydro-1-benzofuran-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone
CID 106877027
(3-amino-2,5-difluorophenyl)-(2,3-dihydro-1H-inden-5-yl)methanone
CID 107123674
2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone
CID 43338936
(2-bromo-5-fluorophenyl)-(2,3-dihydro-1H-inden-5-yl)methanone
CID 43338923
(4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)methanone
CID 106877008
(4-chloro-3-fluorophenyl)-(4-fluoro-2,6-dimethylphenyl)methanone
CID 107998445
(3,5-dibromophenyl)-(2,3-dihydro-1H-inden-5-yl)methanone
CID 107979596
2,3-dihydro-1H-inden-5-yl(naphthalen-2-yl)methanone
CID 43338934
(4-fluoro-2,6-dimethylphenyl)-(3-fluoro-4-methoxyphenyl)methanone
CID 106876723
(2-fluoro-4,6-dimethylphenyl)-(1,2,3,4-tetrahydroisoquinolin-7-yl)methanone
CID 106883144
(3-amino-5-bromo-2-methylphenyl)-(2,3-dihydro-1H-inden-5-yl)methanone
CID 107874132

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone?
The IUPAC name of 2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone (CID 106877016) is 2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone.
What is the SMILES notation for 2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone?
The canonical SMILES for 2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone is Cc1cc(F)cc(C)c1C(=O)c1ccc2c(c1)CCC2.
What is the InChIKey of 2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone?
The InChIKey is CFQWBIBFHOSYFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FO/c1-11-8-16(19)9-12(2)17(11)18(20)15-7-6-13-4-3-5-14(13)10-15/h6-10H,3-5H2,1-2H3.
What are the key properties of 2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone?
2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone has a molecular weight of 268.33 g/mol, XLogP of 4.16, 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-(4-fluoro-2,6-dimethylphenyl)methanone is sourced from PubChem (CID 106877016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).