3-[1-(hydroxyamino)ethyl]phenol

C8H11NO2 — CID 82684421

IUPAC3-[1-(hydroxyamino)ethyl]phenol
SMILESCC(NO)c1cccc(O)c1
InChIInChI=1S/C8H11NO2/c1-6(9-11)7-3-2-4-8(10)5-7/h2-6,9-11H,1H3
InChIKeyIYZSBRZDKDUHOW-UHFFFAOYSA-N
MW153.18 g/mol
LogP1.43
Rot. Bonds2

About 3-[1-(hydroxyamino)ethyl]phenol

3-[1-(hydroxyamino)ethyl]phenol (PubChem CID 82684421) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is 3-[1-(hydroxyamino)ethyl]phenol.

Molecular Properties

Compound Name3-[1-(hydroxyamino)ethyl]phenol
PubChem CID82684421
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Name3-[1-(hydroxyamino)ethyl]phenol
SMILESCC(NO)c1cccc(O)c1
InChIInChI=1S/C8H11NO2/c1-6(9-11)7-3-2-4-8(10)5-7/h2-6,9-11H,1H3
InChIKeyIYZSBRZDKDUHOW-UHFFFAOYSA-N
XLogP1.43
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 51.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[1-(hydroxyamino)ethyl]phenol?
The IUPAC name of 3-[1-(hydroxyamino)ethyl]phenol (CID 82684421) is 3-[1-(hydroxyamino)ethyl]phenol.
What is the SMILES notation for 3-[1-(hydroxyamino)ethyl]phenol?
The canonical SMILES for 3-[1-(hydroxyamino)ethyl]phenol is CC(NO)c1cccc(O)c1.
What is the InChIKey of 3-[1-(hydroxyamino)ethyl]phenol?
The InChIKey is IYZSBRZDKDUHOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c1-6(9-11)7-3-2-4-8(10)5-7/h2-6,9-11H,1H3.
What are the key properties of 3-[1-(hydroxyamino)ethyl]phenol?
3-[1-(hydroxyamino)ethyl]phenol has a molecular weight of 153.18 g/mol, XLogP of 1.43, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(hydroxyamino)ethyl]phenol is sourced from PubChem (CID 82684421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).