2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol

C10H13F2NO — CID 84670019

IUPAC2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol
SMILESCC(F)(F)c1cccc(CCN)c1O
InChIInChI=1S/C10H13F2NO/c1-10(11,12)8-4-2-3-7(5-6-13)9(8)14/h2-4,14H,5-6,13H2,1H3
InChIKeyKUFUXDFVEUTZAQ-UHFFFAOYSA-N
MW201.22 g/mol
LogP2.01
Rot. Bonds3

About 2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol

2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol (PubChem CID 84670019) has the molecular formula C10H13F2NO and a molecular weight of 201.22 g/mol. Its IUPAC name is 2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol.

Molecular Properties

Compound Name2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol
PubChem CID84670019
Molecular FormulaC10H13F2NO
Molecular Weight201.22 g/mol
Exact Mass201.10
IUPAC Name2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol
SMILESCC(F)(F)c1cccc(CCN)c1O
InChIInChI=1S/C10H13F2NO/c1-10(11,12)8-4-2-3-7(5-6-13)9(8)14/h2-4,14H,5-6,13H2,1H3
InChIKeyKUFUXDFVEUTZAQ-UHFFFAOYSA-N
XLogP2.01
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol 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-amino-6-(1,1-difluoroethyl)phenol
CID 84654556
2-[2-methyl-3-(trifluoromethyl)phenyl]ethanamine;hydrochloride
CID 19704221
4-[2-(1,1-difluoroethyl)phenyl]butan-1-amine
CID 117304302
3-[3-(2-fluoropropan-2-yl)-2-hydroxyphenyl]propanoic acid
CID 84690441
(2S)-2-amino-2-[2-(2-aminoethyl)phenyl]propan-1-ol
CID 55295656
2-[3-(dimethylamino)propyl]-6-(trifluoromethyl)phenol
CID 170865710
2-tert-butyl-6-pentadecylphenol
CID 151192860
2-(aminooxymethyl)-6-(trifluoromethyl)phenol
CID 117295390
2-[3-fluoro-2-(trifluoromethyl)phenyl]ethanamine
CID 84674830
4-(3-tert-butyl-2-hydroxyphenyl)butanoic acid
CID 117345129
1-[3-(aminomethyl)-2-fluorophenyl]-1,1-difluoro-2-methylpropan-2-ol
CID 167311067
2-[2-(1-methoxy-2-methylpropan-2-yl)phenyl]ethanamine
CID 117110840

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol?
The IUPAC name of 2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol (CID 84670019) is 2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol.
What is the SMILES notation for 2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol?
The canonical SMILES for 2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol is CC(F)(F)c1cccc(CCN)c1O.
What is the InChIKey of 2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol?
The InChIKey is KUFUXDFVEUTZAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F2NO/c1-10(11,12)8-4-2-3-7(5-6-13)9(8)14/h2-4,14H,5-6,13H2,1H3.
What are the key properties of 2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol?
2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol has a molecular weight of 201.22 g/mol, XLogP of 2.01, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethyl)-6-(1,1-difluoroethyl)phenol is sourced from PubChem (CID 84670019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).