5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine

C15H25NO2 — CID 105133972

IUPAC5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine
SMILESCNC(Cc1cccc(OC)c1)CC(C)COC
InChIInChI=1S/C15H25NO2/c1-12(11-17-3)8-14(16-2)9-13-6-5-7-15(10-13)18-4/h5-7,10,12,14,16H,8-9,11H2,1-4H3
InChIKeyIIJUWSMXBNYPSA-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.50
Rot. Bonds8

About 5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine

5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine (PubChem CID 105133972) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine.

Molecular Properties

Compound Name5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine
PubChem CID105133972
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine
SMILESCNC(Cc1cccc(OC)c1)CC(C)COC
InChIInChI=1S/C15H25NO2/c1-12(11-17-3)8-14(16-2)9-13-6-5-7-15(10-13)18-4/h5-7,10,12,14,16H,8-9,11H2,1-4H3
InChIKeyIIJUWSMXBNYPSA-UHFFFAOYSA-N
XLogP2.50
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine?
The IUPAC name of 5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine (CID 105133972) is 5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine.
What is the SMILES notation for 5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine?
The canonical SMILES for 5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine is CNC(Cc1cccc(OC)c1)CC(C)COC.
What is the InChIKey of 5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine?
The InChIKey is IIJUWSMXBNYPSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-12(11-17-3)8-14(16-2)9-13-6-5-7-15(10-13)18-4/h5-7,10,12,14,16H,8-9,11H2,1-4H3.
What are the key properties of 5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine?
5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine has a molecular weight of 251.37 g/mol, XLogP of 2.50, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-(3-methoxyphenyl)-N,4-dimethylpentan-2-amine is sourced from PubChem (CID 105133972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).