1-(2-methoxyphenyl)-N-methylpropan-2-amine

C11H17NO — CID 4117

💊View drug profile → methoxyphenamine
IUPAC1-(2-methoxyphenyl)-N-methylpropan-2-amine
SMILESCNC(C)Cc1ccccc1OC
InChIInChI=1S/C11H17NO/c1-9(12-2)8-10-6-4-5-7-11(10)13-3/h4-7,9,12H,8H2,1-3H3
InChIKeyOEHAYUOVELTAPG-UHFFFAOYSA-N
MW179.26 g/mol
LogP1.85
Rot. Bonds4

About 1-(2-methoxyphenyl)-N-methylpropan-2-amine

1-(2-methoxyphenyl)-N-methylpropan-2-amine (PubChem CID 4117) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-methylpropan-2-amine
PubChem CID4117
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name1-(2-methoxyphenyl)-N-methylpropan-2-amine
SMILESCNC(C)Cc1ccccc1OC
InChIInChI=1S/C11H17NO/c1-9(12-2)8-10-6-4-5-7-11(10)13-3/h4-7,9,12H,8H2,1-3H3
InChIKeyOEHAYUOVELTAPG-UHFFFAOYSA-N
XLogP1.85
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-methylpropan-2-amine?
The IUPAC name of 1-(2-methoxyphenyl)-N-methylpropan-2-amine (CID 4117) is 1-(2-methoxyphenyl)-N-methylpropan-2-amine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-methylpropan-2-amine?
The canonical SMILES for 1-(2-methoxyphenyl)-N-methylpropan-2-amine is CNC(C)Cc1ccccc1OC.
What is the InChIKey of 1-(2-methoxyphenyl)-N-methylpropan-2-amine?
The InChIKey is OEHAYUOVELTAPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-9(12-2)8-10-6-4-5-7-11(10)13-3/h4-7,9,12H,8H2,1-3H3.
What are the key properties of 1-(2-methoxyphenyl)-N-methylpropan-2-amine?
1-(2-methoxyphenyl)-N-methylpropan-2-amine has a molecular weight of 179.26 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-methylpropan-2-amine is sourced from PubChem (CID 4117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).