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

C17H14F3NO3 — CID 59493172

IUPAC2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypropanamide
SMILESCC(Oc1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2)C(N)=O
InChIInChI=1S/C17H14F3NO3/c1-9(15(21)22)24-10-6-7-12-11-4-2-3-5-13(11)16(23,14(12)8-10)17(18,19)20/h2-9,23H,1H3,(H2,21,22)
InChIKeyBKRPHUWNPOACNB-UHFFFAOYSA-N
MW337.30 g/mol
LogP2.72
Rot. Bonds3

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

2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypropanamide (PubChem CID 59493172) has the molecular formula C17H14F3NO3 and a molecular weight of 337.30 g/mol. Its IUPAC name is 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypropanamide.

Molecular Properties

Compound Name2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypropanamide
PubChem CID59493172
Molecular FormulaC17H14F3NO3
Molecular Weight337.30 g/mol
Exact Mass337.09
IUPAC Name2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypropanamide
SMILESCC(Oc1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2)C(N)=O
InChIInChI=1S/C17H14F3NO3/c1-9(15(21)22)24-10-6-7-12-11-4-2-3-5-13(11)16(23,14(12)8-10)17(18,19)20/h2-9,23H,1H3,(H2,21,22)
InChIKeyBKRPHUWNPOACNB-UHFFFAOYSA-N
XLogP2.72
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.30
LogP ≤ 52.72
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
2-Hexoxy-9-(trifluoromethyl)fluoren-9-ol
CID 59492533
3-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N,N-dimethylpropanamide
CID 59492562
2-[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide
CID 59492583
tert-butyl N-[2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]carbamate
CID 59492591
N-[2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]-N-methylacetamide
CID 59492614
2-Butoxy-9-(trifluoromethyl)fluoren-9-ol
CID 59492669
2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N,N-dimethylacetamide
CID 59492675
4-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N,N-dimethylbutanamide
CID 59492684
2-[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-1-pyrrolidin-1-ylethanone
CID 59492720
1-(Azetidin-1-yl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethanone
CID 59492759

Frequently Asked Questions

What is the IUPAC name of 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypropanamide?
The IUPAC name of 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypropanamide (CID 59493172) is 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypropanamide.
What is the SMILES notation for 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypropanamide?
The canonical SMILES for 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypropanamide is CC(Oc1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2)C(N)=O.
What is the InChIKey of 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypropanamide?
The InChIKey is BKRPHUWNPOACNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14F3NO3/c1-9(15(21)22)24-10-6-7-12-11-4-2-3-5-13(11)16(23,14(12)8-10)17(18,19)20/h2-9,23H,1H3,(H2,21,22).
What are the key properties of 2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypropanamide?
2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypropanamide has a molecular weight of 337.30 g/mol, XLogP of 2.72, 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]oxypropanamide is sourced from PubChem (CID 59493172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).