N-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine

C16H19N — CID 66480423

IUPACN-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine
SMILESCNCc1ccc(-c2cccc(C)c2)c(C)c1
InChIInChI=1S/C16H19N/c1-12-5-4-6-15(9-12)16-8-7-14(11-17-3)10-13(16)2/h4-10,17H,11H2,1-3H3
InChIKeyYSWOPMBTKFIVIZ-UHFFFAOYSA-N
MW225.33 g/mol
LogP3.69
Rot. Bonds3

About N-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine

N-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine (PubChem CID 66480423) has the molecular formula C16H19N and a molecular weight of 225.33 g/mol. Its IUPAC name is N-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine
PubChem CID66480423
Molecular FormulaC16H19N
Molecular Weight225.33 g/mol
Exact Mass225.15
IUPAC NameN-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine
SMILESCNCc1ccc(-c2cccc(C)c2)c(C)c1
InChIInChI=1S/C16H19N/c1-12-5-4-6-15(9-12)16-8-7-14(11-17-3)10-13(16)2/h4-10,17H,11H2,1-3H3
InChIKeyYSWOPMBTKFIVIZ-UHFFFAOYSA-N
XLogP3.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[4-(3-fluoro-5-methylphenyl)-3-methylphenyl]-N-methylmethanamine
CID 79690685
N-methyl-1-[3-methyl-4-(3-nitrophenyl)phenyl]methanamine
CID 66479824
N-methyl-1-(3-methyl-4-naphthalen-2-ylphenyl)methanamine
CID 66481024
1-[4-(2-fluoro-5-methylphenyl)-3-methylphenyl]-N-methylmethanamine
CID 66479816
N-methyl-1-[3-methyl-4-(4-propan-2-ylphenyl)phenyl]methanamine
CID 66481817
1-[4-(4-cyclopropylphenyl)-3-methylphenyl]-N-methylmethanamine
CID 142025209
1-[4-(4-fluoro-2-methylphenyl)-3-methylphenyl]-N-methylmethanamine
CID 66481802
1-[4-(2,4-dimethylphenyl)-3-fluorophenyl]-N-methylmethanamine
CID 81446952
1-[4-(3-chloro-4-methoxyphenyl)-3-methylphenyl]-N-methylmethanamine
CID 66481251
N-[[4-methyl-3-(3-methylphenyl)phenyl]methyl]propan-2-amine
CID 105408477
1-[3-(2,4-dimethylphenyl)phenyl]-2,4-dimethylbenzene
CID 90996196
N-methyl-1-[3-[2-(3-methylphenyl)ethyl]phenyl]methanamine
CID 145495304

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine?
The IUPAC name of N-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine (CID 66480423) is N-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine.
What is the SMILES notation for N-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine?
The canonical SMILES for N-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine is CNCc1ccc(-c2cccc(C)c2)c(C)c1.
What is the InChIKey of N-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine?
The InChIKey is YSWOPMBTKFIVIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-12-5-4-6-15(9-12)16-8-7-14(11-17-3)10-13(16)2/h4-10,17H,11H2,1-3H3.
What are the key properties of N-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine?
N-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine has a molecular weight of 225.33 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine is sourced from PubChem (CID 66480423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).