(2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol

C10H15NO2 — CID 638516

IUPAC(2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol
SMILESCOc1cccc(C)c1[C@H](N)CO
InChIInChI=1S/C10H15NO2/c1-7-4-3-5-9(13-2)10(7)8(11)6-12/h3-5,8,12H,6,11H2,1-2H3/t8-/m1/s1
InChIKeyAFMQFALHAYHYEZ-MRVPVSSYSA-N
MW181.23 g/mol
LogP1.00
Rot. Bonds3

About (2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol

(2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol (PubChem CID 638516) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is (2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol.

Molecular Properties

Compound Name(2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol
PubChem CID638516
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name(2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol
SMILESCOc1cccc(C)c1[C@H](N)CO
InChIInChI=1S/C10H15NO2/c1-7-4-3-5-9(13-2)10(7)8(11)6-12/h3-5,8,12H,6,11H2,1-2H3/t8-/m1/s1
InChIKeyAFMQFALHAYHYEZ-MRVPVSSYSA-N
XLogP1.00
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-amino-2-hydroxyethyl)-3-methoxyphenol
CID 77129655
1-(2-methoxy-6-methylphenyl)ethane-1,2-diamine
CID 55283458
2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol
CID 77129779
2-amino-2-[2-(hydroxymethyl)-6-methylphenyl]ethanol
CID 130042273
2-amino-2-(2-bromo-6-methylphenyl)ethanol
CID 130062182
2-amino-2-(2-methoxyphenyl)ethanol
CID 10352062
(3R)-3-amino-3-(2,6-dimethoxyphenyl)propan-1-ol;hydrochloride
CID 171201207
2-[tert-butyl(dimethyl)silyl]oxy-1-(2-methoxy-6-methylphenyl)ethanamine
CID 22297973
(2S)-2-amino-2-(2,3-dimethoxyphenyl)ethanol
CID 55278202
(2S)-2-azido-2-(2-methoxy-6-methylphenyl)ethanol
CID 638643
1-(2,6-dimethoxyphenyl)ethane-1,2-diamine
CID 22756535
2-[(1S)-1-amino-2-hydroxyethyl]-6-methoxyphenol;hydrochloride
CID 171212313

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol?
The IUPAC name of (2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol (CID 638516) is (2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol.
What is the SMILES notation for (2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol?
The canonical SMILES for (2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol is COc1cccc(C)c1[C@H](N)CO.
What is the InChIKey of (2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol?
The InChIKey is AFMQFALHAYHYEZ-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-7-4-3-5-9(13-2)10(7)8(11)6-12/h3-5,8,12H,6,11H2,1-2H3/t8-/m1/s1.
What are the key properties of (2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol?
(2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol has a molecular weight of 181.23 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol is sourced from PubChem (CID 638516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).