N-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine

C18H23N — CID 43488020

IUPACN-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine
SMILESCCNC(c1ccc(C)cc1)c1ccc(C)c(C)c1
InChIInChI=1S/C18H23N/c1-5-19-18(16-9-6-13(2)7-10-16)17-11-8-14(3)15(4)12-17/h6-12,18-19H,5H2,1-4H3
InChIKeyPFORVMAPWQWVMN-UHFFFAOYSA-N
MW253.39 g/mol
LogP4.31
Rot. Bonds4

About N-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine

N-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine (PubChem CID 43488020) has the molecular formula C18H23N and a molecular weight of 253.39 g/mol. Its IUPAC name is N-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine
PubChem CID43488020
Molecular FormulaC18H23N
Molecular Weight253.39 g/mol
Exact Mass253.18
IUPAC NameN-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine
SMILESCCNC(c1ccc(C)cc1)c1ccc(C)c(C)c1
InChIInChI=1S/C18H23N/c1-5-19-18(16-9-6-13(2)7-10-16)17-11-8-14(3)15(4)12-17/h6-12,18-19H,5H2,1-4H3
InChIKeyPFORVMAPWQWVMN-UHFFFAOYSA-N
XLogP4.31
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2,5-dimethylphenyl)-(3,4-dimethylphenyl)methyl]ethanamine
CID 43487964
N-[(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]ethanamine
CID 115567471
N-[(3,4-dimethylphenyl)-(2-fluoro-5-methylphenyl)methyl]ethanamine
CID 62515681
N-[(4-methylphenyl)-phenylmethyl]ethanamine
CID 43389847
N-[(3-chloro-4-methylphenyl)-(4-chloro-3-methylphenyl)methyl]ethanamine
CID 107562052
1-(3,4-dimethylphenyl)-N-ethyl-2-(4-methylphenyl)ethanamine
CID 43487935
N-[(3-bromo-4-methoxyphenyl)-(3,4-dimethylphenyl)methyl]ethanamine
CID 43487806
N-[(2,4-dichlorophenyl)-(3,4-dimethylphenyl)methyl]ethanamine
CID 43487938
N-[(3,4-dimethylphenyl)-(4-iodophenyl)methyl]propan-1-amine
CID 43493978
N-[(5-chloro-2-methylphenyl)-(4-methylphenyl)methyl]ethanamine
CID 82884123
N-[(3,4-dimethylphenyl)-(4-fluorophenyl)methyl]propan-1-amine
CID 43494021
N-[(4-chloro-3-methylphenyl)-(3-fluoro-4-methylphenyl)methyl]ethanamine
CID 107130379

Frequently Asked Questions

What is the IUPAC name of N-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine?
The IUPAC name of N-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine (CID 43488020) is N-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine.
What is the SMILES notation for N-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine?
The canonical SMILES for N-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine is CCNC(c1ccc(C)cc1)c1ccc(C)c(C)c1.
What is the InChIKey of N-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine?
The InChIKey is PFORVMAPWQWVMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N/c1-5-19-18(16-9-6-13(2)7-10-16)17-11-8-14(3)15(4)12-17/h6-12,18-19H,5H2,1-4H3.
What are the key properties of N-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine?
N-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine has a molecular weight of 253.39 g/mol, XLogP of 4.31, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,4-dimethylphenyl)-(4-methylphenyl)methyl]ethanamine is sourced from PubChem (CID 43488020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).