2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide

C15H9ClF3NO2 — CID 59492566

IUPAC2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide
SMILESNC(=O)c1cc(Cl)cc2c1-c1ccccc1C2(O)C(F)(F)F
InChIInChI=1S/C15H9ClF3NO2/c16-7-5-9(13(20)21)12-8-3-1-2-4-10(8)14(22,11(12)6-7)15(17,18)19/h1-6,22H,(H2,20,21)
InChIKeyOPYVISBRFKUBKF-UHFFFAOYSA-N
MW327.69 g/mol
LogP3.22
Rot. Bonds1

About 2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide

2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide (PubChem CID 59492566) has the molecular formula C15H9ClF3NO2 and a molecular weight of 327.69 g/mol. Its IUPAC name is 2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide.

Molecular Properties

Compound Name2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide
PubChem CID59492566
Molecular FormulaC15H9ClF3NO2
Molecular Weight327.69 g/mol
Exact Mass327.03
IUPAC Name2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide
SMILESNC(=O)c1cc(Cl)cc2c1-c1ccccc1C2(O)C(F)(F)F
InChIInChI=1S/C15H9ClF3NO2/c16-7-5-9(13(20)21)12-8-3-1-2-4-10(8)14(22,11(12)6-7)15(17,18)19/h1-6,22H,(H2,20,21)
InChIKeyOPYVISBRFKUBKF-UHFFFAOYSA-N
XLogP3.22
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.69
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide?
The IUPAC name of 2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide (CID 59492566) is 2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide.
What is the SMILES notation for 2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide?
The canonical SMILES for 2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide is NC(=O)c1cc(Cl)cc2c1-c1ccccc1C2(O)C(F)(F)F.
What is the InChIKey of 2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide?
The InChIKey is OPYVISBRFKUBKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClF3NO2/c16-7-5-9(13(20)21)12-8-3-1-2-4-10(8)14(22,11(12)6-7)15(17,18)19/h1-6,22H,(H2,20,21).
What are the key properties of 2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide?
2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide has a molecular weight of 327.69 g/mol, XLogP of 3.22, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide is sourced from PubChem (CID 59492566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).