1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine

C18H23NO — CID 103434169

IUPAC1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine
SMILESCNCc1ccc(C)c(-c2ccc(C)c(C)c2OC)c1
InChIInChI=1S/C18H23NO/c1-12-7-9-16(18(20-5)14(12)3)17-10-15(11-19-4)8-6-13(17)2/h6-10,19H,11H2,1-5H3
InChIKeyFBMZLLUXBSRELN-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.01
Rot. Bonds4

About 1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine

1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine (PubChem CID 103434169) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine
PubChem CID103434169
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine
SMILESCNCc1ccc(C)c(-c2ccc(C)c(C)c2OC)c1
InChIInChI=1S/C18H23NO/c1-12-7-9-16(18(20-5)14(12)3)17-10-15(11-19-4)8-6-13(17)2/h6-10,19H,11H2,1-5H3
InChIKeyFBMZLLUXBSRELN-UHFFFAOYSA-N
XLogP4.01
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[4-(2-methoxy-3,4-dimethylphenyl)-3-methylphenyl]methyl]ethanamine
CID 103434154
1-[3-(4-chloronaphthalen-1-yl)-4-methylphenyl]-N-methylmethanamine
CID 105410094
N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine
CID 105408323
1-[3-(2-chloro-4,5-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine
CID 105410126
1-[3-(2,5-difluoro-4-methylphenyl)-4-methylphenyl]-N-methylmethanamine
CID 105410107
1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine
CID 105408607
1-[3-(4-chloro-3-methoxyphenyl)-4-methylphenyl]-N-methylmethanamine
CID 105409070
1-[4-fluoro-3-(5-fluoro-2-methylphenyl)phenyl]-N-methylmethanamine
CID 54911947
1-[4-(3-chloro-4-methoxyphenyl)-3-methylphenyl]-N-methylmethanamine
CID 66481251
4-(2-methoxy-3,4-dimethylphenyl)-3-methylaniline
CID 103434076
1-[3-(3-bromo-2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine
CID 106646455
acetonitrile;1-(3-methoxy-4-methylphenyl)-N-methylmethanamine;molecular hydrogen
CID 176959319

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine?
The IUPAC name of 1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine (CID 103434169) is 1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine?
The canonical SMILES for 1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine is CNCc1ccc(C)c(-c2ccc(C)c(C)c2OC)c1.
What is the InChIKey of 1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine?
The InChIKey is FBMZLLUXBSRELN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-12-7-9-16(18(20-5)14(12)3)17-10-15(11-19-4)8-6-13(17)2/h6-10,19H,11H2,1-5H3.
What are the key properties of 1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine?
1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine has a molecular weight of 269.39 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine is sourced from PubChem (CID 103434169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).