1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol

C10H10Cl2F3NO — CID 60899604

IUPAC1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol
SMILESOC(CNCC(F)(F)F)c1cc(Cl)ccc1Cl
InChIInChI=1S/C10H10Cl2F3NO/c11-6-1-2-8(12)7(3-6)9(17)4-16-5-10(13,14)15/h1-3,9,16-17H,4-5H2
InChIKeyOPPLNNFXOCRHQK-UHFFFAOYSA-N
MW288.10 g/mol
LogP3.18
Rot. Bonds4

About 1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol

1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol (PubChem CID 60899604) has the molecular formula C10H10Cl2F3NO and a molecular weight of 288.10 g/mol. Its IUPAC name is 1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol.

Molecular Properties

Compound Name1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol
PubChem CID60899604
Molecular FormulaC10H10Cl2F3NO
Molecular Weight288.10 g/mol
Exact Mass287.01
IUPAC Name1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol
SMILESOC(CNCC(F)(F)F)c1cc(Cl)ccc1Cl
InChIInChI=1S/C10H10Cl2F3NO/c11-6-1-2-8(12)7(3-6)9(17)4-16-5-10(13,14)15/h1-3,9,16-17H,4-5H2
InChIKeyOPPLNNFXOCRHQK-UHFFFAOYSA-N
XLogP3.18
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.10
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol 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 1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol?
The IUPAC name of 1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol (CID 60899604) is 1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol.
What is the SMILES notation for 1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol?
The canonical SMILES for 1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol is OC(CNCC(F)(F)F)c1cc(Cl)ccc1Cl.
What is the InChIKey of 1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol?
The InChIKey is OPPLNNFXOCRHQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Cl2F3NO/c11-6-1-2-8(12)7(3-6)9(17)4-16-5-10(13,14)15/h1-3,9,16-17H,4-5H2.
What are the key properties of 1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol?
1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol has a molecular weight of 288.10 g/mol, XLogP of 3.18, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dichlorophenyl)-2-(2,2,2-trifluoroethylamino)ethanol is sourced from PubChem (CID 60899604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).