1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine

C16H18ClNO2 — CID 60880037

IUPAC1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
SMILESCNCc1cc(OC)ccc1OCc1ccccc1Cl
InChIInChI=1S/C16H18ClNO2/c1-18-10-13-9-14(19-2)7-8-16(13)20-11-12-5-3-4-6-15(12)17/h3-9,18H,10-11H2,1-2H3
InChIKeyQVNDVMYCUVGEDJ-UHFFFAOYSA-N
MW291.78 g/mol
LogP3.65
Rot. Bonds6

About 1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine

1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine (PubChem CID 60880037) has the molecular formula C16H18ClNO2 and a molecular weight of 291.78 g/mol. Its IUPAC name is 1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
PubChem CID60880037
Molecular FormulaC16H18ClNO2
Molecular Weight291.78 g/mol
Exact Mass291.10
IUPAC Name1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
SMILESCNCc1cc(OC)ccc1OCc1ccccc1Cl
InChIInChI=1S/C16H18ClNO2/c1-18-10-13-9-14(19-2)7-8-16(13)20-11-12-5-3-4-6-15(12)17/h3-9,18H,10-11H2,1-2H3
InChIKeyQVNDVMYCUVGEDJ-UHFFFAOYSA-N
XLogP3.65
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.78
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]methyl]ethanamine
CID 60878145
2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene
CID 43268073
1-[2-[(2-bromophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
CID 60880406
[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]methanol
CID 43267981
1-[2-[[4-methoxy-2-(methylaminomethyl)phenyl]methoxy]phenyl]-N-methylmethanamine
CID 123641873
1-[2-[(3-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
CID 60880600
1-(2-ethoxy-5-methoxyphenyl)-N-methylmethanamine
CID 43276259
N-[[3-chloro-4-[(2-chlorophenyl)methoxy]phenyl]methyl]-4-methoxyaniline
CID 126121410
N-[[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methyl]-1-(4-methoxyphenyl)methanamine
CID 4724119
1-[2-[(3,5-dimethylphenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
CID 61028878
methyl 2-[(2-chlorophenyl)methoxy]-4-methoxybenzoate
CID 25235977
1-[2-[(2-bromo-5-methoxyphenyl)methoxy]-5-methylphenyl]-N-methylmethanamine
CID 65321998

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine?
The IUPAC name of 1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine (CID 60880037) is 1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine is CNCc1cc(OC)ccc1OCc1ccccc1Cl.
What is the InChIKey of 1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine?
The InChIKey is QVNDVMYCUVGEDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClNO2/c1-18-10-13-9-14(19-2)7-8-16(13)20-11-12-5-3-4-6-15(12)17/h3-9,18H,10-11H2,1-2H3.
What are the key properties of 1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine?
1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine has a molecular weight of 291.78 g/mol, XLogP of 3.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine is sourced from PubChem (CID 60880037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).