2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol

C12H19NO2 — CID 84677143

IUPAC2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol
SMILESCc1ccc(C(C)C)c(C(O)CN)c1O
InChIInChI=1S/C12H19NO2/c1-7(2)9-5-4-8(3)12(15)11(9)10(14)6-13/h4-5,7,10,14-15H,6,13H2,1-3H3
InChIKeyGXOOZSXYCCYBGG-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.82
Rot. Bonds3

About 2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol

2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol (PubChem CID 84677143) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol.

Molecular Properties

Compound Name2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol
PubChem CID84677143
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol
SMILESCc1ccc(C(C)C)c(C(O)CN)c1O
InChIInChI=1S/C12H19NO2/c1-7(2)9-5-4-8(3)12(15)11(9)10(14)6-13/h4-5,7,10,14-15H,6,13H2,1-3H3
InChIKeyGXOOZSXYCCYBGG-UHFFFAOYSA-N
XLogP1.82
TPSA66.48 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-1-(3-methoxy-4-methyl-2-propan-2-ylphenyl)ethanol
CID 84688656
2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol
CID 117318735
3-(1-aminoethyl)-6-methylbenzene-1,2-diol
CID 84652680
2-[(2-hydroxy-3-methyl-6-propan-2-ylphenyl)diazenyl]-6-methyl-3-propan-2-ylphenol
CID 175998451
2-(1-amino-2-hydroxypropyl)-3,6-dimethylphenol
CID 130059979
2-(4-aminobutyl)-3-methyl-6-propan-2-ylphenol
CID 117317044
3-(3-amino-1-hydroxypropyl)-2-chloro-6-methylphenol
CID 83835781
6-(1-aminopropan-2-yl)-2-fluoro-3-methylphenol
CID 117279608
1-methyl-2,3,4-tri(propan-2-yl)benzene
CID 22369929
2-(2-amino-1-hydroxyethyl)-4-ethyl-6-methylphenol
CID 83879423
2-amino-1-(2,4-dimethylphenyl)ethanol;hydrochloride
CID 137346924
2-ethyl-3-methyl-6-propan-2-ylphenol
CID 141031385

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol?
The IUPAC name of 2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol (CID 84677143) is 2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol.
What is the SMILES notation for 2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol?
The canonical SMILES for 2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol is Cc1ccc(C(C)C)c(C(O)CN)c1O.
What is the InChIKey of 2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol?
The InChIKey is GXOOZSXYCCYBGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-7(2)9-5-4-8(3)12(15)11(9)10(14)6-13/h4-5,7,10,14-15H,6,13H2,1-3H3.
What are the key properties of 2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol?
2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol has a molecular weight of 209.29 g/mol, XLogP of 1.82, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol is sourced from PubChem (CID 84677143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).