2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide

C16H11ClF3NO3 — CID 59492816

IUPAC2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide
SMILESNC(=O)COc1cc(Cl)c2c(c1)C(O)(C(F)(F)F)c1ccccc1-2
InChIInChI=1S/C16H11ClF3NO3/c17-12-6-8(24-7-13(21)22)5-11-14(12)9-3-1-2-4-10(9)15(11,23)16(18,19)20/h1-6,23H,7H2,(H2,21,22)
InChIKeyRVQUDFMXBAJCML-UHFFFAOYSA-N
MW357.72 g/mol
LogP2.98
Rot. Bonds3

About 2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide

2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide (PubChem CID 59492816) has the molecular formula C16H11ClF3NO3 and a molecular weight of 357.72 g/mol. Its IUPAC name is 2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide.

Molecular Properties

Compound Name2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide
PubChem CID59492816
Molecular FormulaC16H11ClF3NO3
Molecular Weight357.72 g/mol
Exact Mass357.04
IUPAC Name2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide
SMILESNC(=O)COc1cc(Cl)c2c(c1)C(O)(C(F)(F)F)c1ccccc1-2
InChIInChI=1S/C16H11ClF3NO3/c17-12-6-8(24-7-13(21)22)5-11-14(12)9-3-1-2-4-10(9)15(11,23)16(18,19)20/h1-6,23H,7H2,(H2,21,22)
InChIKeyRVQUDFMXBAJCML-UHFFFAOYSA-N
XLogP2.98
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.72
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide
CID 59492583
(4-Chloro-9-hydroxy-9-trifluoromethyl-9h-fluoren-2-yloxy)-acetic acid methyl ester
CID 59492703
4-[4-Chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxybutanoic acid
CID 59492709
4-Chloro-2-(5-hydroxypentoxy)-9-(trifluoromethyl)fluoren-9-ol
CID 59492741
2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide
CID 59492909
N-[2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]-2-hydroxy-N-methylacetamide
CID 59492991
5-[4-Chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypentanoic acid
CID 59492993
N-[2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]-N-methylacetamide
CID 59493221
4-[4-Chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxybutanamide
CID 59493230
(4-Chloro-9-hydroxy-9-trifluoromethyl-9h-fluoren-2-yloxy)-acetic acid
CID 59492592
2-[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypropanamide
CID 59493172
(9R)-4-Chloro-2-(3-hydroxy-3-methylbutoxy)-9-(trifluoromethyl)-9H-fluoren-9-ol
CID 117599101

Frequently Asked Questions

What is the IUPAC name of 2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide?
The IUPAC name of 2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide (CID 59492816) is 2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide.
What is the SMILES notation for 2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide?
The canonical SMILES for 2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide is NC(=O)COc1cc(Cl)c2c(c1)C(O)(C(F)(F)F)c1ccccc1-2.
What is the InChIKey of 2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide?
The InChIKey is RVQUDFMXBAJCML-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClF3NO3/c17-12-6-8(24-7-13(21)22)5-11-14(12)9-3-1-2-4-10(9)15(11,23)16(18,19)20/h1-6,23H,7H2,(H2,21,22).
What are the key properties of 2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide?
2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide has a molecular weight of 357.72 g/mol, XLogP of 2.98, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide is sourced from PubChem (CID 59492816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).