4-(1-amino-2-hydroxyethyl)-2-fluorophenol

C8H10FNO2 — CID 55282986

IUPAC4-(1-amino-2-hydroxyethyl)-2-fluorophenol
SMILESNC(CO)c1ccc(O)c(F)c1
InChIInChI=1S/C8H10FNO2/c9-6-3-5(7(10)4-11)1-2-8(6)12/h1-3,7,11-12H,4,10H2
InChIKeyRTUHFQCQTIEVGW-UHFFFAOYSA-N
MW171.17 g/mol
LogP0.52
Rot. Bonds2

About 4-(1-amino-2-hydroxyethyl)-2-fluorophenol

4-(1-amino-2-hydroxyethyl)-2-fluorophenol (PubChem CID 55282986) has the molecular formula C8H10FNO2 and a molecular weight of 171.17 g/mol. Its IUPAC name is 4-(1-amino-2-hydroxyethyl)-2-fluorophenol.

Molecular Properties

Compound Name4-(1-amino-2-hydroxyethyl)-2-fluorophenol
PubChem CID55282986
Molecular FormulaC8H10FNO2
Molecular Weight171.17 g/mol
Exact Mass171.07
IUPAC Name4-(1-amino-2-hydroxyethyl)-2-fluorophenol
SMILESNC(CO)c1ccc(O)c(F)c1
InChIInChI=1S/C8H10FNO2/c9-6-3-5(7(10)4-11)1-2-8(6)12/h1-3,7,11-12H,4,10H2
InChIKeyRTUHFQCQTIEVGW-UHFFFAOYSA-N
XLogP0.52
TPSA66.48 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.17
LogP ≤ 50.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-(3,4-difluorophenyl)ethanol
CID 22048878
4-[(1S)-1-amino-3,3-difluoropropyl]-2-fluorophenol
CID 131499575
2-amino-2-(4-amino-3-fluorophenyl)ethanol
CID 55283111
2-amino-2-[3-fluoro-4-(hydroxymethyl)phenyl]ethanol
CID 55273327
(2R)-2-amino-2-(3-fluoro-4-iodophenyl)ethanol
CID 66515738
4-[(1R)-1-amino-3,3,3-trifluoropropyl]-2-fluorophenol;hydrochloride
CID 171198755
4-[(1R)-1-aminobutyl]-2-fluorophenol;hydrochloride
CID 171198748
4-[(1S)-1-amino-2-hydroxyethyl]-2-chlorophenol
CID 55277962
2-amino-2-(4-chloro-3-fluorophenyl)ethanol;hydrochloride
CID 71757971
4-[(1S)-1-amino-3-hydroxy-2,2-dimethylpropyl]-2-fluorophenol
CID 131542060
(2S)-2-amino-2-[3-(difluoromethyl)-4-fluorophenyl]ethanol
CID 66514177
(2R)-2-amino-2-(3-amino-4-fluorophenyl)ethanol
CID 66513607

Frequently Asked Questions

What is the IUPAC name of 4-(1-amino-2-hydroxyethyl)-2-fluorophenol?
The IUPAC name of 4-(1-amino-2-hydroxyethyl)-2-fluorophenol (CID 55282986) is 4-(1-amino-2-hydroxyethyl)-2-fluorophenol.
What is the SMILES notation for 4-(1-amino-2-hydroxyethyl)-2-fluorophenol?
The canonical SMILES for 4-(1-amino-2-hydroxyethyl)-2-fluorophenol is NC(CO)c1ccc(O)c(F)c1.
What is the InChIKey of 4-(1-amino-2-hydroxyethyl)-2-fluorophenol?
The InChIKey is RTUHFQCQTIEVGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO2/c9-6-3-5(7(10)4-11)1-2-8(6)12/h1-3,7,11-12H,4,10H2.
What are the key properties of 4-(1-amino-2-hydroxyethyl)-2-fluorophenol?
4-(1-amino-2-hydroxyethyl)-2-fluorophenol has a molecular weight of 171.17 g/mol, XLogP of 0.52, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-amino-2-hydroxyethyl)-2-fluorophenol is sourced from PubChem (CID 55282986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).