1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine

C18H23NO3 — CID 58767870

IUPAC1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine
SMILESCOc1ccccc1OCC(C)(N)COc1ccccc1C
InChIInChI=1S/C18H23NO3/c1-14-8-4-5-9-15(14)21-12-18(2,19)13-22-17-11-7-6-10-16(17)20-3/h4-11H,12-13,19H2,1-3H3
InChIKeyAJUJOUDTWJFEGL-UHFFFAOYSA-N
MW301.39 g/mol
LogP3.18
Rot. Bonds7

About 1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine

1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine (PubChem CID 58767870) has the molecular formula C18H23NO3 and a molecular weight of 301.39 g/mol. Its IUPAC name is 1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine.

Molecular Properties

Compound Name1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine
PubChem CID58767870
Molecular FormulaC18H23NO3
Molecular Weight301.39 g/mol
Exact Mass301.17
IUPAC Name1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine
SMILESCOc1ccccc1OCC(C)(N)COc1ccccc1C
InChIInChI=1S/C18H23NO3/c1-14-8-4-5-9-15(14)21-12-18(2,19)13-22-17-11-7-6-10-16(17)20-3/h4-11H,12-13,19H2,1-3H3
InChIKeyAJUJOUDTWJFEGL-UHFFFAOYSA-N
XLogP3.18
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine?
The IUPAC name of 1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine (CID 58767870) is 1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine.
What is the SMILES notation for 1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine?
The canonical SMILES for 1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine is COc1ccccc1OCC(C)(N)COc1ccccc1C.
What is the InChIKey of 1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine?
The InChIKey is AJUJOUDTWJFEGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO3/c1-14-8-4-5-9-15(14)21-12-18(2,19)13-22-17-11-7-6-10-16(17)20-3/h4-11H,12-13,19H2,1-3H3.
What are the key properties of 1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine?
1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine has a molecular weight of 301.39 g/mol, XLogP of 3.18, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenoxy)-2-methyl-3-(2-methylphenoxy)propan-2-amine is sourced from PubChem (CID 58767870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).