2-amino-3-(1-hydroxyethyl)phenol

C8H11NO2 — CID 21298381

IUPAC2-amino-3-(1-hydroxyethyl)phenol
SMILESCC(O)c1cccc(O)c1N
InChIInChI=1S/C8H11NO2/c1-5(10)6-3-2-4-7(11)8(6)9/h2-5,10-11H,9H2,1H3
InChIKeyZMXCHQUWDLPZAA-UHFFFAOYSA-N
MW153.18 g/mol
LogP1.03
Rot. Bonds1

About 2-amino-3-(1-hydroxyethyl)phenol

2-amino-3-(1-hydroxyethyl)phenol (PubChem CID 21298381) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is 2-amino-3-(1-hydroxyethyl)phenol.

Molecular Properties

Compound Name2-amino-3-(1-hydroxyethyl)phenol
PubChem CID21298381
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Name2-amino-3-(1-hydroxyethyl)phenol
SMILESCC(O)c1cccc(O)c1N
InChIInChI=1S/C8H11NO2/c1-5(10)6-3-2-4-7(11)8(6)9/h2-5,10-11H,9H2,1H3
InChIKeyZMXCHQUWDLPZAA-UHFFFAOYSA-N
XLogP1.03
TPSA66.48 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 51.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(2,3-diaminophenyl)ethanol
CID 18668016
2-bromo-3-[(1R)-1-hydroxyethyl]phenol
CID 118486754
2-amino-3-[hydroxy-(4-methylphenyl)methyl]phenol
CID 105486543
(1S)-1-(2-aminophenyl)ethanol
CID 12749796
ethyl (3S)-3-(2-amino-3-hydroxyphenyl)butanoate
CID 174422298
2-methyl-6-propan-2-ylaniline
CID 162117439
2-amino-3-methylsulfanylphenol
CID 23540046
(2S,4S)-2-amino-4-(2-amino-3-hydroxyphenyl)-4-hydroxybutanoic acid
CID 22848160
3-[(1R,2S)-1-amino-2-hydroxypropyl]benzene-1,2-diol;hydrochloride
CID 171261358
3-[(1R,2R)-1-amino-2-hydroxypropyl]-2-methylphenol
CID 130792014
(1S,2S)-1-amino-1-(2,3-diaminophenyl)propan-2-ol
CID 55294728
2-chloro-6-propan-2-ylaniline
CID 18981698

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(1-hydroxyethyl)phenol?
The IUPAC name of 2-amino-3-(1-hydroxyethyl)phenol (CID 21298381) is 2-amino-3-(1-hydroxyethyl)phenol.
What is the SMILES notation for 2-amino-3-(1-hydroxyethyl)phenol?
The canonical SMILES for 2-amino-3-(1-hydroxyethyl)phenol is CC(O)c1cccc(O)c1N.
What is the InChIKey of 2-amino-3-(1-hydroxyethyl)phenol?
The InChIKey is ZMXCHQUWDLPZAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c1-5(10)6-3-2-4-7(11)8(6)9/h2-5,10-11H,9H2,1H3.
What are the key properties of 2-amino-3-(1-hydroxyethyl)phenol?
2-amino-3-(1-hydroxyethyl)phenol has a molecular weight of 153.18 g/mol, XLogP of 1.03, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(1-hydroxyethyl)phenol is sourced from PubChem (CID 21298381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).