2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol

C12H19NO2 — CID 117299270

IUPAC2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol
SMILESCOc1ccc(C)c(O)c1CC(C)(C)N
InChIInChI=1S/C12H19NO2/c1-8-5-6-10(15-4)9(11(8)14)7-12(2,3)13/h5-6,14H,7,13H2,1-4H3
InChIKeyQNNPIMPIBPTGDG-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.99
Rot. Bonds3

About 2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol

2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol (PubChem CID 117299270) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol.

Molecular Properties

Compound Name2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol
PubChem CID117299270
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol
SMILESCOc1ccc(C)c(O)c1CC(C)(C)N
InChIInChI=1S/C12H19NO2/c1-8-5-6-10(15-4)9(11(8)14)7-12(2,3)13/h5-6,14H,7,13H2,1-4H3
InChIKeyQNNPIMPIBPTGDG-UHFFFAOYSA-N
XLogP1.99
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3,6-dimethoxy-2-(methoxymethyl)phenyl]-2-methylpropan-2-amine
CID 117386547
6-(2-amino-2-methylpropyl)-3-methoxy-2-methylphenol
CID 117299283
1-(3-fluoro-2,6-dimethoxyphenyl)-2-methylpropan-2-amine
CID 117327192
(2-hydroxy-6-methoxy-3-methylphenyl)methanesulfonyl chloride
CID 117380100
1-(3-methoxy-4-methylphenyl)-2-methylpropan-2-amine
CID 83698352
1-(2-methoxy-4,6-dimethylphenyl)-2-methylpropan-2-amine
CID 82470482
1-[2-(fluoromethyl)-6-methoxyphenyl]-2-methylpropan-2-amine
CID 117302010
1-(2-fluoro-3,6-dimethylphenyl)-2-methylpropan-2-amine
CID 84773717
2-amino-1-(2-hydroxy-6-methoxy-3-methylphenyl)ethanone
CID 117285154
1-(3,4-dimethoxy-2-methylphenyl)-2-methylpropan-2-amine
CID 117320489
1-[2-(fluoromethyl)-3-methoxyphenyl]-2-methylpropan-2-amine
CID 117302009
1-(2-fluoro-3,4-dimethoxyphenyl)-2-methylpropan-2-amine
CID 117327193

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol?
The IUPAC name of 2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol (CID 117299270) is 2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol.
What is the SMILES notation for 2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol?
The canonical SMILES for 2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol is COc1ccc(C)c(O)c1CC(C)(C)N.
What is the InChIKey of 2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol?
The InChIKey is QNNPIMPIBPTGDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-8-5-6-10(15-4)9(11(8)14)7-12(2,3)13/h5-6,14H,7,13H2,1-4H3.
What are the key properties of 2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol?
2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol has a molecular weight of 209.29 g/mol, XLogP of 1.99, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol is sourced from PubChem (CID 117299270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).