2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol

C19H18F3NO — CID 59492618

IUPAC2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol
SMILESCC1CCCN1c1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2
InChIInChI=1S/C19H18F3NO/c1-12-5-4-10-23(12)13-8-9-15-14-6-2-3-7-16(14)18(24,17(15)11-13)19(20,21)22/h2-3,6-9,11-12,24H,4-5,10H2,1H3
InChIKeyQGWYSTBAKRATDB-UHFFFAOYSA-N
MW333.35 g/mol
LogP4.45
Rot. Bonds1

About 2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol

2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol (PubChem CID 59492618) has the molecular formula C19H18F3NO and a molecular weight of 333.35 g/mol. Its IUPAC name is 2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol.

Molecular Properties

Compound Name2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol
PubChem CID59492618
Molecular FormulaC19H18F3NO
Molecular Weight333.35 g/mol
Exact Mass333.13
IUPAC Name2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol
SMILESCC1CCCN1c1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2
InChIInChI=1S/C19H18F3NO/c1-12-5-4-10-23(12)13-8-9-15-14-6-2-3-7-16(14)18(24,17(15)11-13)19(20,21)22/h2-3,6-9,11-12,24H,4-5,10H2,1H3
InChIKeyQGWYSTBAKRATDB-UHFFFAOYSA-N
XLogP4.45
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.35
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol?
The IUPAC name of 2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol (CID 59492618) is 2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol.
What is the SMILES notation for 2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol?
The canonical SMILES for 2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol is CC1CCCN1c1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2.
What is the InChIKey of 2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol?
The InChIKey is QGWYSTBAKRATDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F3NO/c1-12-5-4-10-23(12)13-8-9-15-14-6-2-3-7-16(14)18(24,17(15)11-13)19(20,21)22/h2-3,6-9,11-12,24H,4-5,10H2,1H3.
What are the key properties of 2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol?
2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol has a molecular weight of 333.35 g/mol, XLogP of 4.45, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol is sourced from PubChem (CID 59492618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).