N-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine

C20H27N — CID 43482466

IUPACN-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine
SMILESCNC(c1cccc(C)c1)c1c(C)c(C)c(C)c(C)c1C
InChIInChI=1S/C20H27N/c1-12-9-8-10-18(11-12)20(21-7)19-16(5)14(3)13(2)15(4)17(19)6/h8-11,20-21H,1-7H3
InChIKeyUYRWRKZQXPYCLC-UHFFFAOYSA-N
MW281.44 g/mol
LogP4.85
Rot. Bonds3

About N-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine

N-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine (PubChem CID 43482466) has the molecular formula C20H27N and a molecular weight of 281.44 g/mol. Its IUPAC name is N-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine
PubChem CID43482466
Molecular FormulaC20H27N
Molecular Weight281.44 g/mol
Exact Mass281.21
IUPAC NameN-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine
SMILESCNC(c1cccc(C)c1)c1c(C)c(C)c(C)c(C)c1C
InChIInChI=1S/C20H27N/c1-12-9-8-10-18(11-12)20(21-7)19-16(5)14(3)13(2)15(4)17(19)6/h8-11,20-21H,1-7H3
InChIKeyUYRWRKZQXPYCLC-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-(3-fluorophenyl)-N-methyl-1-(2,3,4,5,6-pentamethylphenyl)methanamine
CID 43482464
1-(3,4-dimethylphenyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 43480217
1-(4-iodophenyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 115790034
N-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine
CID 115789821
N-methyl-1-(3-methylphenyl)-1-pyrimidin-5-ylmethanamine
CID 62491535
1-(3,4-diethylphenyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 115482251
1-(3-bromo-4-methylphenyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 115790289
1-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 43481682
1-(4-fluoro-3-methylphenyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 60930098
N-methyl-1-(3-methylphenyl)-1-(4-methylsulfanylphenyl)methanamine
CID 115790405
1-(3-bromo-4-fluorophenyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 79747347
N-methyl-1-(3-methylphenyl)-1-(2,3,4-trifluorophenyl)methanamine
CID 62965810

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine?
The IUPAC name of N-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine (CID 43482466) is N-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine.
What is the SMILES notation for N-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine?
The canonical SMILES for N-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine is CNC(c1cccc(C)c1)c1c(C)c(C)c(C)c(C)c1C.
What is the InChIKey of N-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine?
The InChIKey is UYRWRKZQXPYCLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N/c1-12-9-8-10-18(11-12)20(21-7)19-16(5)14(3)13(2)15(4)17(19)6/h8-11,20-21H,1-7H3.
What are the key properties of N-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine?
N-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)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-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine is sourced from PubChem (CID 43482466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).