2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol

C8H10FNO2 — CID 84765888

IUPAC2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol
SMILESCN(O)Cc1ccc(F)c(O)c1
InChIInChI=1S/C8H10FNO2/c1-10(12)5-6-2-3-7(9)8(11)4-6/h2-4,11-12H,5H2,1H3
InChIKeySYIFURQAINNGFY-UHFFFAOYSA-N
MW171.17 g/mol
LogP1.35
Rot. Bonds2

About 2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol

2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol (PubChem CID 84765888) has the molecular formula C8H10FNO2 and a molecular weight of 171.17 g/mol. Its IUPAC name is 2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol.

Molecular Properties

Compound Name2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol
PubChem CID84765888
Molecular FormulaC8H10FNO2
Molecular Weight171.17 g/mol
Exact Mass171.07
IUPAC Name2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol
SMILESCN(O)Cc1ccc(F)c(O)c1
InChIInChI=1S/C8H10FNO2/c1-10(12)5-6-2-3-7(9)8(11)4-6/h2-4,11-12H,5H2,1H3
InChIKeySYIFURQAINNGFY-UHFFFAOYSA-N
XLogP1.35
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.17
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-chloro-3-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol
CID 84778798
5-(aminomethyl)-2-fluorophenol;hydrobromide
CID 68744209
5-[2-(dipropylamino)ethyl]-2-fluorophenol;hydrobromide
CID 14901828
5-[(2R)-2-aminopropyl]-2-(18F)fluoro(18F)phenol
CID 67474806
2-fluoro-4-[[methyl(propan-2-yl)amino]methyl]phenol
CID 107693926
(4-fluoro-3-hydroxyphenyl)methyl acetate
CID 130354561
2-fluoro-4-[[hydroxy(methyl)amino]methyl]-5-methylphenol
CID 84769622
methyl 2-[(3,4-difluorophenyl)methyl-methylamino]acetate
CID 78912327
4-[[ethyl(propan-2-yl)amino]methyl]-2-fluorophenol
CID 107693937
1-chloro-N-[(3,4-difluorophenyl)methyl]-N-methylpropan-2-amine
CID 104555121
5-[2-[ethyl(2-phenylethyl)amino]ethyl]-2-fluorophenol;hydrobromide
CID 14901824
4-[[1-(dimethylamino)propan-2-yl-ethylamino]methyl]-2-fluorophenol
CID 107694130

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol?
The IUPAC name of 2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol (CID 84765888) is 2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol.
What is the SMILES notation for 2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol?
The canonical SMILES for 2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol is CN(O)Cc1ccc(F)c(O)c1.
What is the InChIKey of 2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol?
The InChIKey is SYIFURQAINNGFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO2/c1-10(12)5-6-2-3-7(9)8(11)4-6/h2-4,11-12H,5H2,1H3.
What are the key properties of 2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol?
2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol has a molecular weight of 171.17 g/mol, XLogP of 1.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-[[hydroxy(methyl)amino]methyl]phenol is sourced from PubChem (CID 84765888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).