N-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide

C19H18F3NO4 — CID 59492895

IUPACN-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide
SMILESCN(CCO)C(=O)COc1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2
InChIInChI=1S/C19H18F3NO4/c1-23(8-9-24)17(25)11-27-12-6-7-14-13-4-2-3-5-15(13)18(26,16(14)10-12)19(20,21)22/h2-7,10,24,26H,8-9,11H2,1H3
InChIKeyMFAJOCQARYZIDU-UHFFFAOYSA-N
MW381.35 g/mol
LogP2.29
Rot. Bonds5

About N-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide

N-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide (PubChem CID 59492895) has the molecular formula C19H18F3NO4 and a molecular weight of 381.35 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide
PubChem CID59492895
Molecular FormulaC19H18F3NO4
Molecular Weight381.35 g/mol
Exact Mass381.12
IUPAC NameN-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide
SMILESCN(CCO)C(=O)COc1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2
InChIInChI=1S/C19H18F3NO4/c1-23(8-9-24)17(25)11-27-12-6-7-14-13-4-2-3-5-15(13)18(26,16(14)10-12)19(20,21)22/h2-7,10,24,26H,8-9,11H2,1H3
InChIKeyMFAJOCQARYZIDU-UHFFFAOYSA-N
XLogP2.29
TPSA70.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.35
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide with MolForge

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

Launch Full Analysis

Related Compounds

2,7-bis[2-(diethylamino)ethoxy]-9H-fluoren-9-ol
CID 21552322
tert-butyl N-[2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]-N-methylcarbamate
CID 59492476
3-[2-[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]-1,3-oxazinan-2-one
CID 59492478
1-(2-Hydroxyethyl)-5-[[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxymethyl]pyrrolidin-2-one
CID 59492513
2-[3-(Dimethylamino)propoxy]-9-(trifluoromethyl)fluoren-9-ol
CID 59492528
3-[2-[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]-1,3-oxazolidin-2-one
CID 59492540
1-[2-[9-Hydroxy-4-(hydroxymethyl)-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]pyrrolidin-2-one
CID 59492553
5-[[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxymethyl]-1-methylpyrrolidin-2-one
CID 59492559
3-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N,N-dimethylpropanamide
CID 59492562
2-[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide
CID 59492583
5-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N,N-dimethylpentanamide
CID 59492588
tert-butyl N-[2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]carbamate
CID 59492591

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide?
The IUPAC name of N-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide (CID 59492895) is N-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide is CN(CCO)C(=O)COc1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2.
What is the InChIKey of N-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide?
The InChIKey is MFAJOCQARYZIDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F3NO4/c1-23(8-9-24)17(25)11-27-12-6-7-14-13-4-2-3-5-15(13)18(26,16(14)10-12)19(20,21)22/h2-7,10,24,26H,8-9,11H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide?
N-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide has a molecular weight of 381.35 g/mol, XLogP of 2.29, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N-methylacetamide is sourced from PubChem (CID 59492895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).