N-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide

C16H12F3NO2 — CID 59492556

IUPACN-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide
SMILESCC(=O)Nc1ccc2c(c1)-c1ccccc1C2(O)C(F)(F)F
InChIInChI=1S/C16H12F3NO2/c1-9(21)20-10-6-7-14-12(8-10)11-4-2-3-5-13(11)15(14,22)16(17,18)19/h2-8,22H,1H3,(H,20,21)
InChIKeySBIWFADJUSJAPU-UHFFFAOYSA-N
MW307.27 g/mol
LogP3.42
Rot. Bonds1

About N-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide

N-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide (PubChem CID 59492556) has the molecular formula C16H12F3NO2 and a molecular weight of 307.27 g/mol. Its IUPAC name is N-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide.

Molecular Properties

Compound NameN-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide
PubChem CID59492556
Molecular FormulaC16H12F3NO2
Molecular Weight307.27 g/mol
Exact Mass307.08
IUPAC NameN-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide
SMILESCC(=O)Nc1ccc2c(c1)-c1ccccc1C2(O)C(F)(F)F
InChIInChI=1S/C16H12F3NO2/c1-9(21)20-10-6-7-14-12(8-10)11-4-2-3-5-13(11)15(14,22)16(17,18)19/h2-8,22H,1H3,(H,20,21)
InChIKeySBIWFADJUSJAPU-UHFFFAOYSA-N
XLogP3.42
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.27
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide?
The IUPAC name of N-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide (CID 59492556) is N-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide.
What is the SMILES notation for N-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide?
The canonical SMILES for N-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide is CC(=O)Nc1ccc2c(c1)-c1ccccc1C2(O)C(F)(F)F.
What is the InChIKey of N-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide?
The InChIKey is SBIWFADJUSJAPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F3NO2/c1-9(21)20-10-6-7-14-12(8-10)11-4-2-3-5-13(11)15(14,22)16(17,18)19/h2-8,22H,1H3,(H,20,21).
What are the key properties of N-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide?
N-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide has a molecular weight of 307.27 g/mol, XLogP of 3.42, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[9-hydroxy-9-(trifluoromethyl)fluoren-3-yl]acetamide is sourced from PubChem (CID 59492556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).