N-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine

C20H27N — CID 104990389

IUPACN-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine
SMILESCNC(c1cc(C)c(C)cc1C)c1c(C)cc(C)cc1C
InChIInChI=1S/C20H27N/c1-12-8-16(5)19(17(6)9-12)20(21-7)18-11-14(3)13(2)10-15(18)4/h8-11,20-21H,1-7H3
InChIKeyLEZQFDAVKHBOPJ-UHFFFAOYSA-N
MW281.44 g/mol
LogP4.85
Rot. Bonds3

About N-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine

N-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine (PubChem CID 104990389) has the molecular formula C20H27N and a molecular weight of 281.44 g/mol. Its IUPAC name is N-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine
PubChem CID104990389
Molecular FormulaC20H27N
Molecular Weight281.44 g/mol
Exact Mass281.21
IUPAC NameN-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine
SMILESCNC(c1cc(C)c(C)cc1C)c1c(C)cc(C)cc1C
InChIInChI=1S/C20H27N/c1-12-8-16(5)19(17(6)9-12)20(21-7)18-11-14(3)13(2)10-15(18)4/h8-11,20-21H,1-7H3
InChIKeyLEZQFDAVKHBOPJ-UHFFFAOYSA-N
XLogP4.85
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,4-dimethylphenyl)-N-methyl-1-(2,4,5-trimethylphenyl)methanamine
CID 104990383
1-(2-methoxy-5-methylphenyl)-N-methyl-1-(2,4,6-trimethylphenyl)methanamine
CID 43626284
N-methyl-1-(2-methylfuran-3-yl)-1-(2,4,6-trimethylphenyl)methanamine
CID 43484197
1-(2-fluoro-3-methylphenyl)-N-methyl-1-(2,4,6-trimethylphenyl)methanamine
CID 81477388
N-methyl-1-(5-methyl-3-pyridinyl)-1-(2,4,5-trimethylphenyl)methanamine
CID 105155131
1-(3,5-difluorophenyl)-N-methyl-1-(2,4,5-trimethylphenyl)methanamine
CID 64990005
N-methyl-1-(3,4,5-trifluorophenyl)-1-(2,4,5-trimethylphenyl)methanamine
CID 64990056
N,N'-dimethyl-1-(2,4,5-trimethylphenyl)methanediamine
CID 116954358
1-(5-fluoro-2-methylphenyl)-N-methyl-1-(2,4,5-trimethylphenyl)methanamine
CID 64989956
N-methyl-4-[methylamino-(2,4,5-trimethylphenyl)methyl]aniline
CID 116952114
N-methyl-1-(1-methylpyrazol-3-yl)-1-(2,4,6-trimethylphenyl)methanamine
CID 103135486
N-methyl-1-(2,4,6-trimethylphenyl)ethanamine
CID 16770838

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine?
The IUPAC name of N-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine (CID 104990389) is N-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine.
What is the SMILES notation for N-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine?
The canonical SMILES for N-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine is CNC(c1cc(C)c(C)cc1C)c1c(C)cc(C)cc1C.
What is the InChIKey of N-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine?
The InChIKey is LEZQFDAVKHBOPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N/c1-12-8-16(5)19(17(6)9-12)20(21-7)18-11-14(3)13(2)10-15(18)4/h8-11,20-21H,1-7H3.
What are the key properties of N-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine?
N-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine has a molecular weight of 281.44 g/mol, XLogP of 4.85, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2,4,5-trimethylphenyl)-1-(2,4,6-trimethylphenyl)methanamine is sourced from PubChem (CID 104990389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).