[(1R)-2-hydroxy-1-phenylethyl]azanium

C8H12NO+ — CID 6950536

IUPAC[(1R)-2-hydroxy-1-phenylethyl]azanium
SMILES[NH3+][C@@H](CO)c1ccccc1
InChIInChI=1S/C8H11NO/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8,10H,6,9H2/p+1/t8-/m0/s1
InChIKeyIJXJGQCXFSSHNL-QMMMGPOBSA-O
MW138.19 g/mol
LogP-0.04
Rot. Bonds2

About [(1R)-2-hydroxy-1-phenylethyl]azanium

[(1R)-2-hydroxy-1-phenylethyl]azanium (PubChem CID 6950536) has the molecular formula C8H12NO+ and a molecular weight of 138.19 g/mol. Its IUPAC name is [(1R)-2-hydroxy-1-phenylethyl]azanium.

Molecular Properties

Compound Name[(1R)-2-hydroxy-1-phenylethyl]azanium
PubChem CID6950536
Molecular FormulaC8H12NO+
Molecular Weight138.19 g/mol
Exact Mass138.09
IUPAC Name[(1R)-2-hydroxy-1-phenylethyl]azanium
SMILES[NH3+][C@@H](CO)c1ccccc1
InChIInChI=1S/C8H11NO/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8,10H,6,9H2/p+1/t8-/m0/s1
InChIKeyIJXJGQCXFSSHNL-QMMMGPOBSA-O
XLogP-0.04
TPSA47.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.19
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

[(1R)-3-methyl-1-phenylbutyl]azanium
CID 2496574
(2S,5S)-2,5-diphenylhexane-1,6-diol
CID 102169365
ethane;(2R)-2-phenylpropan-1-ol
CID 160644449
ethane;(2S)-2-phenylpropan-1-ol
CID 142206535
2-chloro-3,3-diphenylpropan-1-ol
CID 57151850
(3-hydroxy-2-phenylpropyl)-λ2-stannane
CID 173264317
(Z,2S)-2-phenylpent-3-en-1-ol
CID 129386000
zinc;tris((2S)-2-amino-2-phenylethanol);dichloride
CID 175904832
(2R,3S)-2,3-dibromo-3-phenylpropan-1-ol
CID 11300855
(2S)-2-amino-2-phenylethanol;methanol
CID 160824062
2-(hydroxyamino)-2-phenylethanol
CID 12782000
bis((1,3-dihydroxy-1-phenylpropan-2-yl)azanium);sulfate
CID 56844048

Frequently Asked Questions

What is the IUPAC name of [(1R)-2-hydroxy-1-phenylethyl]azanium?
The IUPAC name of [(1R)-2-hydroxy-1-phenylethyl]azanium (CID 6950536) is [(1R)-2-hydroxy-1-phenylethyl]azanium.
What is the SMILES notation for [(1R)-2-hydroxy-1-phenylethyl]azanium?
The canonical SMILES for [(1R)-2-hydroxy-1-phenylethyl]azanium is [NH3+][C@@H](CO)c1ccccc1.
What is the InChIKey of [(1R)-2-hydroxy-1-phenylethyl]azanium?
The InChIKey is IJXJGQCXFSSHNL-QMMMGPOBSA-O. The full InChI is InChI=1S/C8H11NO/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8,10H,6,9H2/p+1/t8-/m0/s1.
What are the key properties of [(1R)-2-hydroxy-1-phenylethyl]azanium?
[(1R)-2-hydroxy-1-phenylethyl]azanium has a molecular weight of 138.19 g/mol, XLogP of -0.04, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-2-hydroxy-1-phenylethyl]azanium is sourced from PubChem (CID 6950536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).