1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine

C16H19NO2 — CID 62453866

IUPAC1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine
SMILESCNCc1ccccc1COc1cccc(OC)c1
InChIInChI=1S/C16H19NO2/c1-17-11-13-6-3-4-7-14(13)12-19-16-9-5-8-15(10-16)18-2/h3-10,17H,11-12H2,1-2H3
InChIKeyOZZLRPSLVNKHLU-UHFFFAOYSA-N
MW257.33 g/mol
LogP2.99
Rot. Bonds6

About 1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine

1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine (PubChem CID 62453866) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine
PubChem CID62453866
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine
SMILESCNCc1ccccc1COc1cccc(OC)c1
InChIInChI=1S/C16H19NO2/c1-17-11-13-6-3-4-7-14(13)12-19-16-9-5-8-15(10-16)18-2/h3-10,17H,11-12H2,1-2H3
InChIKeyOZZLRPSLVNKHLU-UHFFFAOYSA-N
XLogP2.99
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[(3-chlorophenoxy)methyl]phenyl]-N-methylmethanamine
CID 62460997
N-methyl-1-[2-[(3-methylsulfonylphenoxy)methyl]phenyl]methanamine
CID 62486836
1-[2-[[4-methoxy-2-(methylaminomethyl)phenyl]methoxy]phenyl]-N-methylmethanamine
CID 123641873
N-methyl-1-[2-(pyridin-3-yloxymethyl)phenyl]methanamine
CID 62451935
methyl 3-methoxy-2-[2-[(3-methoxyphenoxy)methyl]phenyl]prop-2-enoate
CID 72740175
N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine
CID 19744687
1-[3-methoxy-2-[(3-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine
CID 60889550
N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine
CID 107314976
1-[2-[(2-bromophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
CID 60880406
1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
CID 60880037
1-[3-[(2-chlorophenyl)methoxy]phenyl]-N-methylmethanamine;hydrochloride
CID 17290694
1-[2-[(3-bromo-5-fluorophenoxy)methyl]phenyl]-N-methylmethanamine
CID 81325621

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine?
The IUPAC name of 1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine (CID 62453866) is 1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine is CNCc1ccccc1COc1cccc(OC)c1.
What is the InChIKey of 1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine?
The InChIKey is OZZLRPSLVNKHLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-17-11-13-6-3-4-7-14(13)12-19-16-9-5-8-15(10-16)18-2/h3-10,17H,11-12H2,1-2H3.
What are the key properties of 1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine?
1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine has a molecular weight of 257.33 g/mol, XLogP of 2.99, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine is sourced from PubChem (CID 62453866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).