[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone

C19H16F3NO2 — CID 59492981

IUPAC[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone
SMILESCC1CCN1C(=O)c1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2
InChIInChI=1S/C19H16F3NO2/c1-11-8-9-23(11)17(24)12-6-7-14-13-4-2-3-5-15(13)18(25,16(14)10-12)19(20,21)22/h2-7,10-11,25H,8-9H2,1H3
InChIKeyFIERJLCQXGOLMV-UHFFFAOYSA-N
MW347.34 g/mol
LogP3.70
Rot. Bonds1

About [9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone

[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone (PubChem CID 59492981) has the molecular formula C19H16F3NO2 and a molecular weight of 347.34 g/mol. Its IUPAC name is [9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone.

Molecular Properties

Compound Name[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone
PubChem CID59492981
Molecular FormulaC19H16F3NO2
Molecular Weight347.34 g/mol
Exact Mass347.11
IUPAC Name[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone
SMILESCC1CCN1C(=O)c1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2
InChIInChI=1S/C19H16F3NO2/c1-11-8-9-23(11)17(24)12-6-7-14-13-4-2-3-5-15(13)18(25,16(14)10-12)19(20,21)22/h2-7,10-11,25H,8-9H2,1H3
InChIKeyFIERJLCQXGOLMV-UHFFFAOYSA-N
XLogP3.70
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.34
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(S)-N-Cyclohexyl-4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)-Nethylbenzamide
CID 24895553
Azetidin-1-yl-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]methanone
CID 59492809
2-Ethyl-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide
CID 59492498
4-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-N,N-dimethylbenzamide
CID 59492504
4-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-N-methylbenzamide
CID 59492517
N,N-diethyl-1-[9-hydroxy-9-(trifluoromethyl)fluorene-2-carbonyl]azetidine-3-carboxamide
CID 59492542
Azetidin-1-yl-[9-hydroxy-4-methyl-9-(trifluoromethyl)fluoren-2-yl]methanone
CID 59492575
[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(3-propoxyazetidin-1-yl)methanone
CID 59492586
(3-Ethoxyazetidin-1-yl)-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]methanone
CID 59492603
1-[9-hydroxy-9-(trifluoromethyl)fluorene-2-carbonyl]-N,N-dimethylazetidine-3-carboxamide
CID 59492625
[4-Chloro-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-[3-(hydroxymethyl)azetidin-1-yl]methanone
CID 59492641
2-(Azetidine-1-carbonyl)-9-hydroxy-9-(trifluoromethyl)fluorene-4-carboxamide
CID 59492652

Frequently Asked Questions

What is the IUPAC name of [9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone?
The IUPAC name of [9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone (CID 59492981) is [9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone.
What is the SMILES notation for [9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone?
The canonical SMILES for [9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone is CC1CCN1C(=O)c1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2.
What is the InChIKey of [9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone?
The InChIKey is FIERJLCQXGOLMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F3NO2/c1-11-8-9-23(11)17(24)12-6-7-14-13-4-2-3-5-15(13)18(25,16(14)10-12)19(20,21)22/h2-7,10-11,25H,8-9H2,1H3.
What are the key properties of [9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone?
[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone has a molecular weight of 347.34 g/mol, XLogP of 3.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]-(2-methylazetidin-1-yl)methanone is sourced from PubChem (CID 59492981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).