1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine

C17H21NO2 — CID 134147951

IUPAC1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine
SMILESCOc1ccccc1-c1cc(CN(C)C)ccc1OC
InChIInChI=1S/C17H21NO2/c1-18(2)12-13-9-10-17(20-4)15(11-13)14-7-5-6-8-16(14)19-3/h5-11H,12H2,1-4H3
InChIKeyYOPLSOPAKSXKIW-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.43
Rot. Bonds5

About 1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine

1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine (PubChem CID 134147951) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine
PubChem CID134147951
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine
SMILESCOc1ccccc1-c1cc(CN(C)C)ccc1OC
InChIInChI=1S/C17H21NO2/c1-18(2)12-13-9-10-17(20-4)15(11-13)14-7-5-6-8-16(14)19-3/h5-11H,12H2,1-4H3
InChIKeyYOPLSOPAKSXKIW-UHFFFAOYSA-N
XLogP3.43
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine (CID 134147951) is 1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine is COc1ccccc1-c1cc(CN(C)C)ccc1OC.
What is the InChIKey of 1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine?
The InChIKey is YOPLSOPAKSXKIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-18(2)12-13-9-10-17(20-4)15(11-13)14-7-5-6-8-16(14)19-3/h5-11H,12H2,1-4H3.
What are the key properties of 1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine?
1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine has a molecular weight of 271.36 g/mol, XLogP of 3.43, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-methoxy-3-(2-methoxyphenyl)phenyl]-N,N-dimethylmethanamine is sourced from PubChem (CID 134147951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).