(1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol

C15H17NO — CID 23726159

IUPAC(1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol
SMILESC[C@H](c1ccccc1N)[C@H](O)c1ccccc1
InChIInChI=1S/C15H17NO/c1-11(13-9-5-6-10-14(13)16)15(17)12-7-3-2-4-8-12/h2-11,15,17H,16H2,1H3/t11-,15+/m1/s1
InChIKeyHUXZIAYQYHIDKN-ABAIWWIYSA-N
MW227.31 g/mol
LogP3.11
Rot. Bonds3

About (1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol

(1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol (PubChem CID 23726159) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is (1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol.

Molecular Properties

Compound Name(1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol
PubChem CID23726159
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name(1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol
SMILESC[C@H](c1ccccc1N)[C@H](O)c1ccccc1
InChIInChI=1S/C15H17NO/c1-11(13-9-5-6-10-14(13)16)15(17)12-7-3-2-4-8-12/h2-11,15,17H,16H2,1H3/t11-,15+/m1/s1
InChIKeyHUXZIAYQYHIDKN-ABAIWWIYSA-N
XLogP3.11
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S,3S)-3-(2-aminophenyl)butan-2-ol
CID 131028904
(1S,2S)-1,2-bis(2-aminophenyl)ethane-1,2-diol
CID 166060261
1-(2-aminophenyl)-2-methylpropan-1-ol
CID 64834180
(1S,2S)-1-(2-aminophenyl)propane-1,2-diol
CID 54485712
(1S)-1-(2-aminophenyl)ethanol
CID 12749796
(1S,2R)-2-amino-1-phenylpropan-1-ol
CID 26934
1,2-diphenylethane-1,2-diol
CID 159073808
(1R,2R)-1-(4-fluorophenyl)-2-phenylpropan-1-ol
CID 134955278
1-[4-(1,2-dihydroxy-2-phenylethyl)phenyl]-2-phenylethane-1,2-diol
CID 14066931
(1S)-1-amino-2-phenylpropan-1-ol
CID 130442875
(2S)-2-chloro-1-phenylpropan-1-ol
CID 146730708
(1S,2S,3R)-2-methyl-1-phenylbutane-1,3-diol
CID 71349785

Frequently Asked Questions

What is the IUPAC name of (1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol?
The IUPAC name of (1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol (CID 23726159) is (1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol.
What is the SMILES notation for (1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol?
The canonical SMILES for (1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol is C[C@H](c1ccccc1N)[C@H](O)c1ccccc1.
What is the InChIKey of (1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol?
The InChIKey is HUXZIAYQYHIDKN-ABAIWWIYSA-N. The full InChI is InChI=1S/C15H17NO/c1-11(13-9-5-6-10-14(13)16)15(17)12-7-3-2-4-8-12/h2-11,15,17H,16H2,1H3/t11-,15+/m1/s1.
What are the key properties of (1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol?
(1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol has a molecular weight of 227.31 g/mol, XLogP of 3.11, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol is sourced from PubChem (CID 23726159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).