1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol

C10H14FNO2 — CID 67395856

IUPAC1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol
SMILESCC(C)(O)COc1cc(F)ccc1N
InChIInChI=1S/C10H14FNO2/c1-10(2,13)6-14-9-5-7(11)3-4-8(9)12/h3-5,13H,6,12H2,1-2H3
InChIKeyDZFKYSMUGOWSBU-UHFFFAOYSA-N
MW199.23 g/mol
LogP1.56
Rot. Bonds3

About 1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol

1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol (PubChem CID 67395856) has the molecular formula C10H14FNO2 and a molecular weight of 199.23 g/mol. Its IUPAC name is 1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol
PubChem CID67395856
Molecular FormulaC10H14FNO2
Molecular Weight199.23 g/mol
Exact Mass199.10
IUPAC Name1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol
SMILESCC(C)(O)COc1cc(F)ccc1N
InChIInChI=1S/C10H14FNO2/c1-10(2,13)6-14-9-5-7(11)3-4-8(9)12/h3-5,13H,6,12H2,1-2H3
InChIKeyDZFKYSMUGOWSBU-UHFFFAOYSA-N
XLogP1.56
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.23
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol 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-(2-amino-2-methylpropoxy)-4-fluoroaniline
CID 117095575
1-[2-[(1S)-1-aminoethyl]-5-fluorophenoxy]-2-methylpropan-2-ol
CID 78935976
2-(2-amino-5-fluorophenoxy)-N-tert-butylacetamide
CID 16772032
1-(5-fluoro-2-nitrophenoxy)-2-methylpropan-2-ol
CID 60879350
4-fluoro-2-(2-methylbutan-2-yloxy)aniline
CID 62377670
4-fluoro-2-octoxyaniline
CID 43128998
tert-butyl N-[3-(2-amino-5-fluorophenoxy)propyl]carbamate
CID 177233914
4-fluoro-2-(4-methylpentoxy)aniline
CID 62377671
4-fluoro-2-(2-propoxyethoxy)aniline
CID 63684494
4-[4-amino-3-(2,2-dimethylpropoxy)phenyl]-2-(2,2-dimethylpropoxy)aniline
CID 139768522
ethane;1-(2-fluoro-4-methylphenoxy)-2-methylpropan-2-ol
CID 145227313
1-(5-bromo-2-fluorophenoxy)-2-methylpropan-2-ol
CID 99716802

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol?
The IUPAC name of 1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol (CID 67395856) is 1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol.
What is the SMILES notation for 1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol?
The canonical SMILES for 1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol is CC(C)(O)COc1cc(F)ccc1N.
What is the InChIKey of 1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol?
The InChIKey is DZFKYSMUGOWSBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO2/c1-10(2,13)6-14-9-5-7(11)3-4-8(9)12/h3-5,13H,6,12H2,1-2H3.
What are the key properties of 1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol?
1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol has a molecular weight of 199.23 g/mol, XLogP of 1.56, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-5-fluorophenoxy)-2-methylpropan-2-ol is sourced from PubChem (CID 67395856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).