1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine

C17H21NO3 — CID 60889550

IUPAC1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine
SMILESCNCc1cccc(OC)c1OCc1cccc(OC)c1
InChIInChI=1S/C17H21NO3/c1-18-11-14-7-5-9-16(20-3)17(14)21-12-13-6-4-8-15(10-13)19-2/h4-10,18H,11-12H2,1-3H3
InChIKeyFKCANSOOJDXPJA-UHFFFAOYSA-N
MW287.36 g/mol
LogP3.00
Rot. Bonds7

About 1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine

1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine (PubChem CID 60889550) has the molecular formula C17H21NO3 and a molecular weight of 287.36 g/mol. Its IUPAC name is 1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine
PubChem CID60889550
Molecular FormulaC17H21NO3
Molecular Weight287.36 g/mol
Exact Mass287.15
IUPAC Name1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine
SMILESCNCc1cccc(OC)c1OCc1cccc(OC)c1
InChIInChI=1S/C17H21NO3/c1-18-11-14-7-5-9-16(20-3)17(14)21-12-13-6-4-8-15(10-13)19-2/h4-10,18H,11-12H2,1-3H3
InChIKeyFKCANSOOJDXPJA-UHFFFAOYSA-N
XLogP3.00
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[2-methoxy-6-(methylaminomethyl)phenoxy]methyl]benzonitrile
CID 60888801
1-[4-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine
CID 61268156
4-[[2-methoxy-6-(methylaminomethyl)phenoxy]methyl]benzonitrile
CID 60889745
[3-ethoxy-2-[(3-methoxyphenyl)methoxy]phenyl]methanamine
CID 60880025
[3-ethoxy-2-[(3-methoxyphenyl)methoxy]phenyl]methanol
CID 43366742
1-[4-[(2,6-dimethoxyphenoxy)methyl]phenyl]-N-methylmethanamine
CID 62450181
N-[[2-[(3-fluorophenyl)methoxy]-3-methoxyphenyl]methyl]ethanamine
CID 43471952
1-[2-[(1-ethylpyrazol-4-yl)methoxy]-3-methoxyphenyl]-N-methylmethanamine
CID 62126144
ethane;1-(3-methoxyphenyl)-N-methylmethanamine
CID 142908093
[2-[(3-methoxyphenyl)methoxy]phenyl]methanamine
CID 19627406
1-[2-methoxy-6-(methylaminomethyl)phenoxy]propan-2-ol
CID 60887437
1-[2-[(3-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
CID 60880600

Frequently Asked Questions

What is the IUPAC name of 1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine?
The IUPAC name of 1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine (CID 60889550) is 1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine?
The canonical SMILES for 1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine is CNCc1cccc(OC)c1OCc1cccc(OC)c1.
What is the InChIKey of 1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine?
The InChIKey is FKCANSOOJDXPJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO3/c1-18-11-14-7-5-9-16(20-3)17(14)21-12-13-6-4-8-15(10-13)19-2/h4-10,18H,11-12H2,1-3H3.
What are the key properties of 1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine?
1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine has a molecular weight of 287.36 g/mol, XLogP of 3.00, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine is sourced from PubChem (CID 60889550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).