1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine

C13H21NO2 — CID 67415487

IUPAC1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine
SMILESCOc1ccccc1OCC(C)(C)N(C)C
InChIInChI=1S/C13H21NO2/c1-13(2,14(3)4)10-16-12-9-7-6-8-11(12)15-5/h6-9H,10H2,1-5H3
InChIKeyAQOUTMOXNXAQIN-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.41
Rot. Bonds5

About 1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine

1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine (PubChem CID 67415487) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine.

Molecular Properties

Compound Name1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine
PubChem CID67415487
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine
SMILESCOc1ccccc1OCC(C)(C)N(C)C
InChIInChI=1S/C13H21NO2/c1-13(2,14(3)4)10-16-12-9-7-6-8-11(12)15-5/h6-9H,10H2,1-5H3
InChIKeyAQOUTMOXNXAQIN-UHFFFAOYSA-N
XLogP2.41
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine?
The IUPAC name of 1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine (CID 67415487) is 1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine.
What is the SMILES notation for 1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine?
The canonical SMILES for 1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine is COc1ccccc1OCC(C)(C)N(C)C.
What is the InChIKey of 1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine?
The InChIKey is AQOUTMOXNXAQIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-13(2,14(3)4)10-16-12-9-7-6-8-11(12)15-5/h6-9H,10H2,1-5H3.
What are the key properties of 1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine?
1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine has a molecular weight of 223.32 g/mol, XLogP of 2.41, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenoxy)-N,N,2-trimethylpropan-2-amine is sourced from PubChem (CID 67415487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).