(2R)-2-amino-2-phenylethanol

C8H11NO — CID 2724025

IUPAC(2R)-2-amino-2-phenylethanol
SMILESN[C@@H](CO)c1ccccc1
InChIInChI=1S/C8H11NO/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8,10H,6,9H2/t8-/m0/s1
InChIKeyIJXJGQCXFSSHNL-QMMMGPOBSA-N
MW137.18 g/mol
LogP0.68
Rot. Bonds2

About (2R)-2-amino-2-phenylethanol

(2R)-2-amino-2-phenylethanol (PubChem CID 2724025) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is (2R)-2-amino-2-phenylethanol.

Molecular Properties

Compound Name(2R)-2-amino-2-phenylethanol
PubChem CID2724025
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name(2R)-2-amino-2-phenylethanol
SMILESN[C@@H](CO)c1ccccc1
InChIInChI=1S/C8H11NO/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8,10H,6,9H2/t8-/m0/s1
InChIKeyIJXJGQCXFSSHNL-QMMMGPOBSA-N
XLogP0.68
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-phenylethanol?
The IUPAC name of (2R)-2-amino-2-phenylethanol (CID 2724025) is (2R)-2-amino-2-phenylethanol.
What is the SMILES notation for (2R)-2-amino-2-phenylethanol?
The canonical SMILES for (2R)-2-amino-2-phenylethanol is N[C@@H](CO)c1ccccc1.
What is the InChIKey of (2R)-2-amino-2-phenylethanol?
The InChIKey is IJXJGQCXFSSHNL-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H11NO/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8,10H,6,9H2/t8-/m0/s1.
What are the key properties of (2R)-2-amino-2-phenylethanol?
(2R)-2-amino-2-phenylethanol has a molecular weight of 137.18 g/mol, XLogP of 0.68, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-phenylethanol is sourced from PubChem (CID 2724025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).