2-(1-amino-3-phenylpropan-2-yl)oxyethanol

C11H17NO2 — CID 103376743

IUPAC2-(1-amino-3-phenylpropan-2-yl)oxyethanol
SMILESNCC(Cc1ccccc1)OCCO
InChIInChI=1S/C11H17NO2/c12-9-11(14-7-6-13)8-10-4-2-1-3-5-10/h1-5,11,13H,6-9,12H2
InChIKeyKGPRJTZYYWNTIO-UHFFFAOYSA-N
MW195.26 g/mol
LogP0.57
Rot. Bonds6

About 2-(1-amino-3-phenylpropan-2-yl)oxyethanol

2-(1-amino-3-phenylpropan-2-yl)oxyethanol (PubChem CID 103376743) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-(1-amino-3-phenylpropan-2-yl)oxyethanol.

Molecular Properties

Compound Name2-(1-amino-3-phenylpropan-2-yl)oxyethanol
PubChem CID103376743
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-(1-amino-3-phenylpropan-2-yl)oxyethanol
SMILESNCC(Cc1ccccc1)OCCO
InChIInChI=1S/C11H17NO2/c12-9-11(14-7-6-13)8-10-4-2-1-3-5-10/h1-5,11,13H,6-9,12H2
InChIKeyKGPRJTZYYWNTIO-UHFFFAOYSA-N
XLogP0.57
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(1-amino-3-phenylpropan-2-yl)oxyethanol 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

2-[4-[tert-butyl(dimethyl)silyl]oxy-1-phenylbutan-2-yl]oxyethanol
CID 18790481
3-(1-amino-3-phenylpropan-2-yl)oxybutan-2-ol
CID 103377034
(2S)-3-phenyl-2-phenylmethoxypropan-1-ol
CID 11831604
(2S)-2-[2-[(2S)-1-methylpiperidin-2-yl]ethoxy]-3-phenylpropan-1-amine
CID 93273066
(2R)-2-fluoro-3-phenylpropan-1-amine
CID 69274217
(2R)-2-methoxy-3-phenylpropan-1-ol
CID 12696531
(1S,2R)-2-[10-[(2R)-1-amino-3-phenylpropan-2-yl]oxydecoxy]-2,3-dihydro-1H-inden-1-amine
CID 155468615
2-[tert-butyl(dimethyl)silyl]oxy-3-phenylpropan-1-amine
CID 14872266
3-phenyl-2-(2-phenylmethoxyphenoxy)propan-1-amine
CID 154520924
2-benzyl-3-phenylpropan-1-amine;hydrochloride
CID 75481010
3-phenyl-2-propan-2-yloxypropan-1-ol
CID 174505154
2-(2-methoxyethoxymethoxy)-3-phenylpropan-1-ol
CID 11424981

Frequently Asked Questions

What is the IUPAC name of 2-(1-amino-3-phenylpropan-2-yl)oxyethanol?
The IUPAC name of 2-(1-amino-3-phenylpropan-2-yl)oxyethanol (CID 103376743) is 2-(1-amino-3-phenylpropan-2-yl)oxyethanol.
What is the SMILES notation for 2-(1-amino-3-phenylpropan-2-yl)oxyethanol?
The canonical SMILES for 2-(1-amino-3-phenylpropan-2-yl)oxyethanol is NCC(Cc1ccccc1)OCCO.
What is the InChIKey of 2-(1-amino-3-phenylpropan-2-yl)oxyethanol?
The InChIKey is KGPRJTZYYWNTIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c12-9-11(14-7-6-13)8-10-4-2-1-3-5-10/h1-5,11,13H,6-9,12H2.
What are the key properties of 2-(1-amino-3-phenylpropan-2-yl)oxyethanol?
2-(1-amino-3-phenylpropan-2-yl)oxyethanol has a molecular weight of 195.26 g/mol, XLogP of 0.57, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-amino-3-phenylpropan-2-yl)oxyethanol is sourced from PubChem (CID 103376743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).