(2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol

C10H15NO3 — CID 55278202

IUPAC(2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol
SMILESCOc1cccc([C@H](N)CO)c1OC
InChIInChI=1S/C10H15NO3/c1-13-9-5-3-4-7(8(11)6-12)10(9)14-2/h3-5,8,12H,6,11H2,1-2H3/t8-/m1/s1
InChIKeyGMSUFURUEUIACW-MRVPVSSYSA-N
MW197.23 g/mol
LogP0.70
Rot. Bonds4

About (2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol

(2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol (PubChem CID 55278202) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is (2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol.

Molecular Properties

Compound Name(2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol
PubChem CID55278202
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC Name(2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol
SMILESCOc1cccc([C@H](N)CO)c1OC
InChIInChI=1S/C10H15NO3/c1-13-9-5-3-4-7(8(11)6-12)10(9)14-2/h3-5,8,12H,6,11H2,1-2H3/t8-/m1/s1
InChIKeyGMSUFURUEUIACW-MRVPVSSYSA-N
XLogP0.70
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol 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-amino-2-(2-ethoxy-3-methoxyphenyl)ethanol
CID 77130049
2-amino-2-(2-methoxyphenyl)ethanol
CID 10352062
(2R)-2-amino-2-(2,3,4-trimethoxyphenyl)ethanol
CID 42579797
(1S)-1-(2,3-dimethoxyphenyl)ethane-1,2-diamine
CID 55278892
(2S)-2-amino-2-(3-methoxy-2-phenylmethoxyphenyl)ethanol
CID 66515873
2-[(1R)-1-amino-2-hydroxyethyl]-6-methoxyphenol;hydrochloride
CID 171231915
2-[(1S)-1-amino-2-hydroxyethyl]-6-methoxyphenol;hydrochloride
CID 171212313
2-amino-2-(3-chloro-2-methoxyphenyl)ethanol
CID 82608026
3-amino-3-(2,3-dimethoxyphenyl)propanamide
CID 43147937
(2R)-2-amino-2-(3-fluoro-2-methoxyphenyl)ethanol;hydrochloride
CID 121235718
2-amino-2-(2-ethyl-3-methoxyphenyl)ethanol
CID 55269244
1-(2,3-dimethoxyphenyl)-3,3,3-trifluoropropan-1-amine
CID 112693542

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol?
The IUPAC name of (2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol (CID 55278202) is (2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol.
What is the SMILES notation for (2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol?
The canonical SMILES for (2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol is COc1cccc([C@H](N)CO)c1OC.
What is the InChIKey of (2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol?
The InChIKey is GMSUFURUEUIACW-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H15NO3/c1-13-9-5-3-4-7(8(11)6-12)10(9)14-2/h3-5,8,12H,6,11H2,1-2H3/t8-/m1/s1.
What are the key properties of (2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol?
(2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol has a molecular weight of 197.23 g/mol, XLogP of 0.70, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol is sourced from PubChem (CID 55278202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).