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

C12H19NO2 — CID 117299283

IUPAC6-(2-amino-2-methylpropyl)-3-methoxy-2-methylphenol
SMILESCOc1ccc(CC(C)(C)N)c(O)c1C
InChIInChI=1S/C12H19NO2/c1-8-10(15-4)6-5-9(11(8)14)7-12(2,3)13/h5-6,14H,7,13H2,1-4H3
InChIKeySOQNZNCZSINDHT-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.99
Rot. Bonds3

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

6-(2-amino-2-methylpropyl)-3-methoxy-2-methylphenol (PubChem CID 117299283) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 6-(2-amino-2-methylpropyl)-3-methoxy-2-methylphenol.

Molecular Properties

Compound Name6-(2-amino-2-methylpropyl)-3-methoxy-2-methylphenol
PubChem CID117299283
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name6-(2-amino-2-methylpropyl)-3-methoxy-2-methylphenol
SMILESCOc1ccc(CC(C)(C)N)c(O)c1C
InChIInChI=1S/C12H19NO2/c1-8-10(15-4)6-5-9(11(8)14)7-12(2,3)13/h5-6,14H,7,13H2,1-4H3
InChIKeySOQNZNCZSINDHT-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-(3,4-dimethoxy-2-methylphenyl)-2-methylpropan-2-amine
CID 117320489
2-(2-amino-2-methylpropyl)-3-methoxy-6-methylphenol
CID 117299270
6-(2-amino-2-methylpropyl)-3-fluoro-2-methoxyphenol
CID 117304251
3,6-dimethoxy-2-methylphenol
CID 13158257
3-(2-amino-2-methylpropyl)-4-methoxyaniline
CID 84665627
1-(2-fluoro-3,4-dimethoxyphenyl)-2-methylpropan-2-amine
CID 117327193
6-(2-amino-2-methylpropyl)-4-bromo-3-methoxy-2-methylphenol
CID 117465337
3-(2-amino-2-methylpropyl)-6-bromo-2-methoxyphenol
CID 117437685
4-(2-amino-2-methylpropyl)-2-methoxy-3,6-dimethylphenol
CID 117320492
6-(2-amino-2-methylpropyl)-2-methoxy-3,4-dimethylphenol
CID 117320493
1-(3-bromo-2-fluoro-4-methoxyphenyl)-2-methylpropan-2-amine
CID 117441916
1-(2-ethyl-3,4-dimethoxyphenyl)-2-methylpropan-2-amine
CID 117347553

Frequently Asked Questions

What is the IUPAC name of 6-(2-amino-2-methylpropyl)-3-methoxy-2-methylphenol?
The IUPAC name of 6-(2-amino-2-methylpropyl)-3-methoxy-2-methylphenol (CID 117299283) is 6-(2-amino-2-methylpropyl)-3-methoxy-2-methylphenol.
What is the SMILES notation for 6-(2-amino-2-methylpropyl)-3-methoxy-2-methylphenol?
The canonical SMILES for 6-(2-amino-2-methylpropyl)-3-methoxy-2-methylphenol is COc1ccc(CC(C)(C)N)c(O)c1C.
What is the InChIKey of 6-(2-amino-2-methylpropyl)-3-methoxy-2-methylphenol?
The InChIKey is SOQNZNCZSINDHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-8-10(15-4)6-5-9(11(8)14)7-12(2,3)13/h5-6,14H,7,13H2,1-4H3.
What are the key properties of 6-(2-amino-2-methylpropyl)-3-methoxy-2-methylphenol?
6-(2-amino-2-methylpropyl)-3-methoxy-2-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 6-(2-amino-2-methylpropyl)-3-methoxy-2-methylphenol is sourced from PubChem (CID 117299283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).