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

C9H13NO — CID 26934

IUPAC(1S,2R)-2-amino-1-phenylpropan-1-ol
SMILESC[C@@H](N)[C@@H](O)c1ccccc1
InChIInChI=1S/C9H13NO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7,9,11H,10H2,1H3/t7-,9-/m1/s1
InChIKeyDLNKOYKMWOXYQA-VXNVDRBHSA-N
MW151.21 g/mol
LogP1.07
Rot. Bonds2

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

(1S,2R)-2-amino-1-phenylpropan-1-ol (PubChem CID 26934) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is (1S,2R)-2-amino-1-phenylpropan-1-ol.

Molecular Properties

Compound Name(1S,2R)-2-amino-1-phenylpropan-1-ol
PubChem CID26934
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name(1S,2R)-2-amino-1-phenylpropan-1-ol
SMILESC[C@@H](N)[C@@H](O)c1ccccc1
InChIInChI=1S/C9H13NO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7,9,11H,10H2,1H3/t7-,9-/m1/s1
InChIKeyDLNKOYKMWOXYQA-VXNVDRBHSA-N
XLogP1.07
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (1S,2R)-2-amino-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

(1S,2R)-2-amino-1-phenylpropan-1-ol;formic acid
CID 118541105
(1R,2S)-2-amino-1-phenylpropan-1-ol;(Z)-but-2-enedioic acid
CID 76960503
(1S,2R)-2-amino-1-phenylpropan-1-ol;(1R,2S)-2-(methylamino)-1-phenylpropan-1-ol;(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol
CID 69186898
(1S,2R)-2-amino-1-phenylpropan-1-ol;benzene-1,2-dicarboxamide
CID 174804503
(1S,2S)-2-amino-3,3,3-trideuterio-1-phenylpropan-1-ol;hydrochloride
CID 76974285
(1S,2R)-2-amino-1-(4-propan-2-ylphenyl)propan-1-ol
CID 28743945
3-[(1R,2S)-2-amino-1-hydroxypropyl]phenol;benzene
CID 70466970
1,2-diphenylethane-1,2-diol
CID 159073808
(1S,2R)-2-amino-1,2-diphenylethanol
CID 719822
(1R,2S)-2-(15N)azanyl-1,2-diphenylethanol
CID 11745978
acetyl chloride;(1R,2S)-2-amino-1-phenylpropan-1-ol;N-[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]acetamide
CID 165079516
4-[(1S,2S)-2-amino-1-hydroxypropyl]phenol;hydrochloride
CID 90673533

Frequently Asked Questions

What is the IUPAC name of (1S,2R)-2-amino-1-phenylpropan-1-ol?
The IUPAC name of (1S,2R)-2-amino-1-phenylpropan-1-ol (CID 26934) is (1S,2R)-2-amino-1-phenylpropan-1-ol.
What is the SMILES notation for (1S,2R)-2-amino-1-phenylpropan-1-ol?
The canonical SMILES for (1S,2R)-2-amino-1-phenylpropan-1-ol is C[C@@H](N)[C@@H](O)c1ccccc1.
What is the InChIKey of (1S,2R)-2-amino-1-phenylpropan-1-ol?
The InChIKey is DLNKOYKMWOXYQA-VXNVDRBHSA-N. The full InChI is InChI=1S/C9H13NO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7,9,11H,10H2,1H3/t7-,9-/m1/s1.
What are the key properties of (1S,2R)-2-amino-1-phenylpropan-1-ol?
(1S,2R)-2-amino-1-phenylpropan-1-ol has a molecular weight of 151.21 g/mol, XLogP of 1.07, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2R)-2-amino-1-phenylpropan-1-ol is sourced from PubChem (CID 26934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).