3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one

C20H19F2NO4 — CID 118119322

IUPAC3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one
SMILESCC(F)(F)C1(O)c2ccccc2-c2ccc(OCCN3CCOC3=O)cc21
InChIInChI=1S/C20H19F2NO4/c1-19(21,22)20(25)16-5-3-2-4-14(16)15-7-6-13(12-17(15)20)26-10-8-23-9-11-27-18(23)24/h2-7,12,25H,8-11H2,1H3
InChIKeyLTNQVOUJBPBXDK-UHFFFAOYSA-N
MW375.37 g/mol
LogP3.39
Rot. Bonds5

About 3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one

3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one (PubChem CID 118119322) has the molecular formula C20H19F2NO4 and a molecular weight of 375.37 g/mol. Its IUPAC name is 3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one
PubChem CID118119322
Molecular FormulaC20H19F2NO4
Molecular Weight375.37 g/mol
Exact Mass375.13
IUPAC Name3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one
SMILESCC(F)(F)C1(O)c2ccccc2-c2ccc(OCCN3CCOC3=O)cc21
InChIInChI=1S/C20H19F2NO4/c1-19(21,22)20(25)16-5-3-2-4-14(16)15-7-6-13(12-17(15)20)26-10-8-23-9-11-27-18(23)24/h2-7,12,25H,8-11H2,1H3
InChIKeyLTNQVOUJBPBXDK-UHFFFAOYSA-N
XLogP3.39
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.37
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-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

Related Compounds

2,7-bis[2-(diethylamino)ethoxy]-9H-fluoren-9-ol
CID 21552322
tert-butyl N-[2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]-N-methylcarbamate
CID 59492476
3-[2-[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]-1,3-oxazinan-2-one
CID 59492478
1-(2-Hydroxyethyl)-5-[[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxymethyl]pyrrolidin-2-one
CID 59492513
2-[3-(Dimethylamino)propoxy]-9-(trifluoromethyl)fluoren-9-ol
CID 59492528
3-[2-[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one
CID 59492540
1-[2-[9-Hydroxy-4-(hydroxymethyl)-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]pyrrolidin-2-one
CID 59492553
5-[[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxymethyl]-1-methylpyrrolidin-2-one
CID 59492559
3-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N,N-dimethylpropanamide
CID 59492562
2-[2-(1,1-Dioxo-1,2-thiazolidin-2-yl)ethoxy]-9-(trifluoromethyl)fluoren-9-ol
CID 59492568
tert-butyl N-[2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]carbamate
CID 59492591
1-[4-(Hydroxymethyl)piperidin-1-yl]-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethanone
CID 59492596

Frequently Asked Questions

What is the IUPAC name of 3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one (CID 118119322) is 3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one is CC(F)(F)C1(O)c2ccccc2-c2ccc(OCCN3CCOC3=O)cc21.
What is the InChIKey of 3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one?
The InChIKey is LTNQVOUJBPBXDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19F2NO4/c1-19(21,22)20(25)16-5-3-2-4-14(16)15-7-6-13(12-17(15)20)26-10-8-23-9-11-27-18(23)24/h2-7,12,25H,8-11H2,1H3.
What are the key properties of 3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one?
3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one has a molecular weight of 375.37 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[9-(1,1-difluoroethyl)-9-hydroxyfluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 118119322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).