2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol

C19H18F3NO — CID 59492873

IUPAC2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol
SMILESCC1CCN(c2ccc3c(c2)C(O)(C(F)(F)F)c2ccccc2-3)C1
InChIInChI=1S/C19H18F3NO/c1-12-8-9-23(11-12)13-6-7-15-14-4-2-3-5-16(14)18(24,17(15)10-13)19(20,21)22/h2-7,10,12,24H,8-9,11H2,1H3
InChIKeyLPALECKBLVYOGR-UHFFFAOYSA-N
MW333.35 g/mol
LogP4.31
Rot. Bonds1

About 2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol

2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol (PubChem CID 59492873) has the molecular formula C19H18F3NO and a molecular weight of 333.35 g/mol. Its IUPAC name is 2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol.

Molecular Properties

Compound Name2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol
PubChem CID59492873
Molecular FormulaC19H18F3NO
Molecular Weight333.35 g/mol
Exact Mass333.13
IUPAC Name2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol
SMILESCC1CCN(c2ccc3c(c2)C(O)(C(F)(F)F)c2ccccc2-3)C1
InChIInChI=1S/C19H18F3NO/c1-12-8-9-23(11-12)13-6-7-15-14-4-2-3-5-16(14)18(24,17(15)10-13)19(20,21)22/h2-7,10,12,24H,8-9,11H2,1H3
InChIKeyLPALECKBLVYOGR-UHFFFAOYSA-N
XLogP4.31
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 ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol?
The IUPAC name of 2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol (CID 59492873) is 2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol.
What is the SMILES notation for 2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol?
The canonical SMILES for 2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol is CC1CCN(c2ccc3c(c2)C(O)(C(F)(F)F)c2ccccc2-3)C1.
What is the InChIKey of 2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol?
The InChIKey is LPALECKBLVYOGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F3NO/c1-12-8-9-23(11-12)13-6-7-15-14-4-2-3-5-16(14)18(24,17(15)10-13)19(20,21)22/h2-7,10,12,24H,8-9,11H2,1H3.
What are the key properties of 2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol?
2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol has a molecular weight of 333.35 g/mol, XLogP of 4.31, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylpyrrolidin-1-yl)-9-(trifluoromethyl)fluoren-9-ol is sourced from PubChem (CID 59492873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).