2-cyclopropyl-2-(4-fluoroanilino)ethanol

C11H14FNO — CID 61310926

IUPAC2-cyclopropyl-2-(4-fluoroanilino)ethanol
SMILESOCC(Nc1ccc(F)cc1)C1CC1
InChIInChI=1S/C11H14FNO/c12-9-3-5-10(6-4-9)13-11(7-14)8-1-2-8/h3-6,8,11,13-14H,1-2,7H2
InChIKeyWPLCPXMVOOMELB-UHFFFAOYSA-N
MW195.24 g/mol
LogP2.01
Rot. Bonds4

About 2-cyclopropyl-2-(4-fluoroanilino)ethanol

2-cyclopropyl-2-(4-fluoroanilino)ethanol (PubChem CID 61310926) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is 2-cyclopropyl-2-(4-fluoroanilino)ethanol.

Molecular Properties

Compound Name2-cyclopropyl-2-(4-fluoroanilino)ethanol
PubChem CID61310926
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name2-cyclopropyl-2-(4-fluoroanilino)ethanol
SMILESOCC(Nc1ccc(F)cc1)C1CC1
InChIInChI=1S/C11H14FNO/c12-9-3-5-10(6-4-9)13-11(7-14)8-1-2-8/h3-6,8,11,13-14H,1-2,7H2
InChIKeyWPLCPXMVOOMELB-UHFFFAOYSA-N
XLogP2.01
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-cyclopropyl-2-(4-fluoroanilino)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 2-cyclopropyl-2-(4-fluoroanilino)ethanol?
The IUPAC name of 2-cyclopropyl-2-(4-fluoroanilino)ethanol (CID 61310926) is 2-cyclopropyl-2-(4-fluoroanilino)ethanol.
What is the SMILES notation for 2-cyclopropyl-2-(4-fluoroanilino)ethanol?
The canonical SMILES for 2-cyclopropyl-2-(4-fluoroanilino)ethanol is OCC(Nc1ccc(F)cc1)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(4-fluoroanilino)ethanol?
The InChIKey is WPLCPXMVOOMELB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c12-9-3-5-10(6-4-9)13-11(7-14)8-1-2-8/h3-6,8,11,13-14H,1-2,7H2.
What are the key properties of 2-cyclopropyl-2-(4-fluoroanilino)ethanol?
2-cyclopropyl-2-(4-fluoroanilino)ethanol has a molecular weight of 195.24 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(4-fluoroanilino)ethanol is sourced from PubChem (CID 61310926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).