4-[(1R)-1-amino-2-hydroxyethyl]phenol

C8H11NO2 — CID 45083049

IUPAC4-[(1R)-1-amino-2-hydroxyethyl]phenol
SMILESN[C@@H](CO)c1ccc(O)cc1
InChIInChI=1S/C8H11NO2/c9-8(5-10)6-1-3-7(11)4-2-6/h1-4,8,10-11H,5,9H2/t8-/m0/s1
InChIKeyWKMNUYYJVXICFJ-QMMMGPOBSA-N
MW153.18 g/mol
LogP0.38
Rot. Bonds2

About 4-[(1R)-1-amino-2-hydroxyethyl]phenol

4-[(1R)-1-amino-2-hydroxyethyl]phenol (PubChem CID 45083049) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is 4-[(1R)-1-amino-2-hydroxyethyl]phenol.

Molecular Properties

Compound Name4-[(1R)-1-amino-2-hydroxyethyl]phenol
PubChem CID45083049
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Name4-[(1R)-1-amino-2-hydroxyethyl]phenol
SMILESN[C@@H](CO)c1ccc(O)cc1
InChIInChI=1S/C8H11NO2/c9-8(5-10)6-1-3-7(11)4-2-6/h1-4,8,10-11H,5,9H2/t8-/m0/s1
InChIKeyWKMNUYYJVXICFJ-QMMMGPOBSA-N
XLogP0.38
TPSA66.48 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 ≤ 50.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(1S)-1,3-diaminopropyl]phenol
CID 130913331
2-amino-2-(4-fluorophenyl)ethanol
CID 14853201
(2R)-2-amino-2-(4-chlorophenyl)ethanol;hydrochloride
CID 67033243
2-amino-2-(4-propan-2-ylphenyl)ethanol;hydrochloride
CID 155487486
4-[(1R)-1-amino-3-methylbutyl]phenol
CID 130812675
(2R)-2-amino-2-(4-tert-butylphenyl)ethanol
CID 55278122
zinc;tris((2S)-2-amino-2-phenylethanol);dichloride
CID 175904832
(2S)-2-amino-2-phenylethanol;methanol
CID 160824062
(2S)-2-amino-2-(4-tert-butylphenyl)ethanol;hydrochloride
CID 135564298
2-amino-2-(4-ethynylphenyl)ethanol
CID 77129671
4-[(1S)-1-amino-2-methoxyethyl]phenol
CID 55292260
2-amino-2-(4-ethylsulfanylphenyl)ethanol
CID 77129802

Frequently Asked Questions

What is the IUPAC name of 4-[(1R)-1-amino-2-hydroxyethyl]phenol?
The IUPAC name of 4-[(1R)-1-amino-2-hydroxyethyl]phenol (CID 45083049) is 4-[(1R)-1-amino-2-hydroxyethyl]phenol.
What is the SMILES notation for 4-[(1R)-1-amino-2-hydroxyethyl]phenol?
The canonical SMILES for 4-[(1R)-1-amino-2-hydroxyethyl]phenol is N[C@@H](CO)c1ccc(O)cc1.
What is the InChIKey of 4-[(1R)-1-amino-2-hydroxyethyl]phenol?
The InChIKey is WKMNUYYJVXICFJ-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H11NO2/c9-8(5-10)6-1-3-7(11)4-2-6/h1-4,8,10-11H,5,9H2/t8-/m0/s1.
What are the key properties of 4-[(1R)-1-amino-2-hydroxyethyl]phenol?
4-[(1R)-1-amino-2-hydroxyethyl]phenol has a molecular weight of 153.18 g/mol, XLogP of 0.38, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1R)-1-amino-2-hydroxyethyl]phenol is sourced from PubChem (CID 45083049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).