2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide

C16H12F3NO3 — CID 59492583

IUPAC2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide
SMILESNC(=O)COc1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2
InChIInChI=1S/C16H12F3NO3/c17-16(18,19)15(22)12-4-2-1-3-10(12)11-6-5-9(7-13(11)15)23-8-14(20)21/h1-7,22H,8H2,(H2,20,21)
InChIKeyQXQUVMCSXVGFJS-UHFFFAOYSA-N
MW323.27 g/mol
LogP2.33
Rot. Bonds3

About 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide

2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide (PubChem CID 59492583) has the molecular formula C16H12F3NO3 and a molecular weight of 323.27 g/mol. Its IUPAC name is 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide.

Molecular Properties

Compound Name2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide
PubChem CID59492583
Molecular FormulaC16H12F3NO3
Molecular Weight323.27 g/mol
Exact Mass323.08
IUPAC Name2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide
SMILESNC(=O)COc1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2
InChIInChI=1S/C16H12F3NO3/c17-16(18,19)15(22)12-4-2-1-3-10(12)11-6-5-9(7-13(11)15)23-8-14(20)21/h1-7,22H,8H2,(H2,20,21)
InChIKeyQXQUVMCSXVGFJS-UHFFFAOYSA-N
XLogP2.33
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.27
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-Hydroxybutoxy)-9-(trifluoromethyl)fluoren-9-ol
CID 59492658
4-[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxybutanoic acid
CID 59492679
tert-butyl N-[2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]-N-methylcarbamate
CID 59492476
2-[3-(Dimethylamino)propoxy]-9-(trifluoromethyl)fluoren-9-ol
CID 59492528
2-Hexoxy-9-(trifluoromethyl)fluoren-9-ol
CID 59492533
3-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N,N-dimethylpropanamide
CID 59492562
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
N-[2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]-N-methylacetamide
CID 59492614
2-Butoxy-9-(trifluoromethyl)fluoren-9-ol
CID 59492669
2-[4-bromo-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide
CID 59492672
2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N,N-dimethylacetamide
CID 59492675

Frequently Asked Questions

What is the IUPAC name of 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide?
The IUPAC name of 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide (CID 59492583) is 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide.
What is the SMILES notation for 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide?
The canonical SMILES for 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide is NC(=O)COc1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2.
What is the InChIKey of 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide?
The InChIKey is QXQUVMCSXVGFJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F3NO3/c17-16(18,19)15(22)12-4-2-1-3-10(12)11-6-5-9(7-13(11)15)23-8-14(20)21/h1-7,22H,8H2,(H2,20,21).
What are the key properties of 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide?
2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide has a molecular weight of 323.27 g/mol, XLogP of 2.33, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide is sourced from PubChem (CID 59492583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).