[5-(aminooxymethyl)-2-fluorophenyl]methanol

C8H10FNO2 — CID 117276845

IUPAC[5-(aminooxymethyl)-2-fluorophenyl]methanol
SMILESNOCc1ccc(F)c(CO)c1
InChIInChI=1S/C8H10FNO2/c9-8-2-1-6(5-12-10)3-7(8)4-11/h1-3,11H,4-5,10H2
InChIKeyGJARFWIQERUWCG-UHFFFAOYSA-N
MW171.17 g/mol
LogP0.71
Rot. Bonds3

About [5-(aminooxymethyl)-2-fluorophenyl]methanol

[5-(aminooxymethyl)-2-fluorophenyl]methanol (PubChem CID 117276845) has the molecular formula C8H10FNO2 and a molecular weight of 171.17 g/mol. Its IUPAC name is [5-(aminooxymethyl)-2-fluorophenyl]methanol.

Molecular Properties

Compound Name[5-(aminooxymethyl)-2-fluorophenyl]methanol
PubChem CID117276845
Molecular FormulaC8H10FNO2
Molecular Weight171.17 g/mol
Exact Mass171.07
IUPAC Name[5-(aminooxymethyl)-2-fluorophenyl]methanol
SMILESNOCc1ccc(F)c(CO)c1
InChIInChI=1S/C8H10FNO2/c9-8-2-1-6(5-12-10)3-7(8)4-11/h1-3,11H,4-5,10H2
InChIKeyGJARFWIQERUWCG-UHFFFAOYSA-N
XLogP0.71
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.17
LogP ≤ 50.71
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

O-[(3,4-difluorophenyl)methyl]hydroxylamine
CID 19876093
[2-fluoro-5-(2,2,2-trifluoroethyl)phenyl]methanol
CID 178139316
O-[(4-bromo-3-fluorophenyl)methyl]hydroxylamine
CID 117313669
4-(aminooxymethyl)-2-fluorobenzoic acid
CID 106698513
O-[(2-fluoro-5-methylphenyl)methyl]hydroxylamine
CID 83808202
[5-bromo-2-[(3,4-difluorophenyl)methoxy]phenyl]methanol
CID 78993100
[2-bromo-5-[(3,4-difluorophenyl)methoxy]phenyl]methanol
CID 82918272
[2-[(3,4-difluorophenyl)methoxy]-3-(hydroxymethyl)-5-methoxyphenyl]methanol
CID 75519404
[4-[(3-chloro-4-fluorophenyl)methoxy]-3,5-difluorophenyl]methanol
CID 103038387
3-[4-fluoro-3-(hydroxymethyl)phenyl]-2,2-dimethylpropanoic acid
CID 117325421
4-fluoro-3-(hydroxymethyl)benzamide
CID 43558815
[3-chloro-2-[(3,4-difluorophenyl)methoxy]phenyl]methanol
CID 112612722

Frequently Asked Questions

What is the IUPAC name of [5-(aminooxymethyl)-2-fluorophenyl]methanol?
The IUPAC name of [5-(aminooxymethyl)-2-fluorophenyl]methanol (CID 117276845) is [5-(aminooxymethyl)-2-fluorophenyl]methanol.
What is the SMILES notation for [5-(aminooxymethyl)-2-fluorophenyl]methanol?
The canonical SMILES for [5-(aminooxymethyl)-2-fluorophenyl]methanol is NOCc1ccc(F)c(CO)c1.
What is the InChIKey of [5-(aminooxymethyl)-2-fluorophenyl]methanol?
The InChIKey is GJARFWIQERUWCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO2/c9-8-2-1-6(5-12-10)3-7(8)4-11/h1-3,11H,4-5,10H2.
What are the key properties of [5-(aminooxymethyl)-2-fluorophenyl]methanol?
[5-(aminooxymethyl)-2-fluorophenyl]methanol has a molecular weight of 171.17 g/mol, XLogP of 0.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(aminooxymethyl)-2-fluorophenyl]methanol is sourced from PubChem (CID 117276845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).