2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol

C11H16FNO3 — CID 107693476

IUPAC2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol
SMILESCOCCNC(CO)c1ccc(O)c(F)c1
InChIInChI=1S/C11H16FNO3/c1-16-5-4-13-10(7-14)8-2-3-11(15)9(12)6-8/h2-3,6,10,13-15H,4-5,7H2,1H3
InChIKeyDDIFZQSLWZARLD-UHFFFAOYSA-N
MW229.25 g/mol
LogP0.80
Rot. Bonds6

About 2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol

2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol (PubChem CID 107693476) has the molecular formula C11H16FNO3 and a molecular weight of 229.25 g/mol. Its IUPAC name is 2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol.

Molecular Properties

Compound Name2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol
PubChem CID107693476
Molecular FormulaC11H16FNO3
Molecular Weight229.25 g/mol
Exact Mass229.11
IUPAC Name2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol
SMILESCOCCNC(CO)c1ccc(O)c(F)c1
InChIInChI=1S/C11H16FNO3/c1-16-5-4-13-10(7-14)8-2-3-11(15)9(12)6-8/h2-3,6,10,13-15H,4-5,7H2,1H3
InChIKeyDDIFZQSLWZARLD-UHFFFAOYSA-N
XLogP0.80
TPSA61.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.25
LogP ≤ 50.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]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-(3,5-difluorophenyl)-2-(2-methoxyethylamino)ethanol
CID 106531859
2-[4-(difluoromethyl)phenyl]-2-(2-methoxyethylamino)ethanol
CID 113328532
2-(3,4-dichlorophenyl)-2-(2-methoxyethylamino)ethanol
CID 62543484
ethyl 2-(3-fluoro-4-hydroxyphenyl)-2-(2-methoxyethylamino)acetate
CID 107690318
2-(4-bromophenyl)-2-(2-methoxyethylamino)ethanol
CID 62543970
2-(2-methoxyethylamino)-2-phenylethanol
CID 62544769
2-fluoro-4-[2-hydroxy-1-(3-methoxyanilino)ethyl]phenol
CID 107693461
4-[1-(butan-2-ylamino)-2-hydroxyethyl]-2-fluorophenol
CID 107693456
4-[1-(4-chloroanilino)-2-hydroxyethyl]-2-fluorophenol
CID 107693464
2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)ethanol
CID 55084367
4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol
CID 107693474
2-fluoro-4-[(1S)-1-(2-hydroxyethylamino)ethyl]phenol
CID 29038991

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol?
The IUPAC name of 2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol (CID 107693476) is 2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol.
What is the SMILES notation for 2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol?
The canonical SMILES for 2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol is COCCNC(CO)c1ccc(O)c(F)c1.
What is the InChIKey of 2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol?
The InChIKey is DDIFZQSLWZARLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNO3/c1-16-5-4-13-10(7-14)8-2-3-11(15)9(12)6-8/h2-3,6,10,13-15H,4-5,7H2,1H3.
What are the key properties of 2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol?
2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol has a molecular weight of 229.25 g/mol, XLogP of 0.80, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-[2-hydroxy-1-(2-methoxyethylamino)ethyl]phenol is sourced from PubChem (CID 107693476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).