2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide

C20H16F3N3O2 — CID 59492840

IUPAC2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide
SMILESCc1cc(-c2cnn(CC(N)=O)c2)c2c(c1)C(O)(C(F)(F)F)c1ccccc1-2
InChIInChI=1S/C20H16F3N3O2/c1-11-6-14(12-8-25-26(9-12)10-17(24)27)18-13-4-2-3-5-15(13)19(28,16(18)7-11)20(21,22)23/h2-9,28H,10H2,1H3,(H2,24,27)
InChIKeyATFQWTQFMRQWII-UHFFFAOYSA-N
MW387.36 g/mol
LogP3.12
Rot. Bonds3

About 2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide

2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide (PubChem CID 59492840) has the molecular formula C20H16F3N3O2 and a molecular weight of 387.36 g/mol. Its IUPAC name is 2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide
PubChem CID59492840
Molecular FormulaC20H16F3N3O2
Molecular Weight387.36 g/mol
Exact Mass387.12
IUPAC Name2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide
SMILESCc1cc(-c2cnn(CC(N)=O)c2)c2c(c1)C(O)(C(F)(F)F)c1ccccc1-2
InChIInChI=1S/C20H16F3N3O2/c1-11-6-14(12-8-25-26(9-12)10-17(24)27)18-13-4-2-3-5-15(13)19(28,16(18)7-11)20(21,22)23/h2-9,28H,10H2,1H3,(H2,24,27)
InChIKeyATFQWTQFMRQWII-UHFFFAOYSA-N
XLogP3.12
TPSA81.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.36
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide?
The IUPAC name of 2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide (CID 59492840) is 2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide.
What is the SMILES notation for 2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide?
The canonical SMILES for 2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide is Cc1cc(-c2cnn(CC(N)=O)c2)c2c(c1)C(O)(C(F)(F)F)c1ccccc1-2.
What is the InChIKey of 2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide?
The InChIKey is ATFQWTQFMRQWII-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F3N3O2/c1-11-6-14(12-8-25-26(9-12)10-17(24)27)18-13-4-2-3-5-15(13)19(28,16(18)7-11)20(21,22)23/h2-9,28H,10H2,1H3,(H2,24,27).
What are the key properties of 2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide?
2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide has a molecular weight of 387.36 g/mol, XLogP of 3.12, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[9-hydroxy-2-methyl-9-(trifluoromethyl)fluoren-4-yl]pyrazol-1-yl]acetamide is sourced from PubChem (CID 59492840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).