(3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one

C20H16F2O — CID 7188277

IUPAC(3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one
SMILESO=C1Cc2ccc(F)cc2C[C@@H]1C1=Cc2ccc(F)cc2CC1
InChIInChI=1S/C20H16F2O/c21-17-5-3-12-7-15(2-1-13(12)8-17)19-10-16-9-18(22)6-4-14(16)11-20(19)23/h3-9,19H,1-2,10-11H2/t19-/m1/s1
InChIKeyBYJRDEVKOGEWIX-LJQANCHMSA-N
MW310.34 g/mol
LogP4.28
Rot. Bonds1

About (3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one

(3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one (PubChem CID 7188277) has the molecular formula C20H16F2O and a molecular weight of 310.34 g/mol. Its IUPAC name is (3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one.

Molecular Properties

Compound Name(3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one
PubChem CID7188277
Molecular FormulaC20H16F2O
Molecular Weight310.34 g/mol
Exact Mass310.12
IUPAC Name(3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one
SMILESO=C1Cc2ccc(F)cc2C[C@@H]1C1=Cc2ccc(F)cc2CC1
InChIInChI=1S/C20H16F2O/c21-17-5-3-12-7-15(2-1-13(12)8-17)19-10-16-9-18(22)6-4-14(16)11-20(19)23/h3-9,19H,1-2,10-11H2/t19-/m1/s1
InChIKeyBYJRDEVKOGEWIX-LJQANCHMSA-N
XLogP4.28
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.34
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-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 (3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one?
The IUPAC name of (3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one (CID 7188277) is (3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one.
What is the SMILES notation for (3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one?
The canonical SMILES for (3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one is O=C1Cc2ccc(F)cc2C[C@@H]1C1=Cc2ccc(F)cc2CC1.
What is the InChIKey of (3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one?
The InChIKey is BYJRDEVKOGEWIX-LJQANCHMSA-N. The full InChI is InChI=1S/C20H16F2O/c21-17-5-3-12-7-15(2-1-13(12)8-17)19-10-16-9-18(22)6-4-14(16)11-20(19)23/h3-9,19H,1-2,10-11H2/t19-/m1/s1.
What are the key properties of (3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one?
(3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one has a molecular weight of 310.34 g/mol, XLogP of 4.28, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-6-fluoro-3-(6-fluoro-3,4-dihydronaphthalen-2-yl)-3,4-dihydro-1H-naphthalen-2-one is sourced from PubChem (CID 7188277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).