1-[4-(2,4-dimethylphenyl)phenyl]ethanamine

C16H19N — CID 61033767

IUPAC1-[4-(2,4-dimethylphenyl)phenyl]ethanamine
SMILESCc1ccc(-c2ccc(C(C)N)cc2)c(C)c1
InChIInChI=1S/C16H19N/c1-11-4-9-16(12(2)10-11)15-7-5-14(6-8-15)13(3)17/h4-10,13H,17H2,1-3H3
InChIKeyNJUQVGOCQIJROI-UHFFFAOYSA-N
MW225.33 g/mol
LogP3.99
Rot. Bonds2

About 1-[4-(2,4-dimethylphenyl)phenyl]ethanamine

1-[4-(2,4-dimethylphenyl)phenyl]ethanamine (PubChem CID 61033767) has the molecular formula C16H19N and a molecular weight of 225.33 g/mol. Its IUPAC name is 1-[4-(2,4-dimethylphenyl)phenyl]ethanamine.

Molecular Properties

Compound Name1-[4-(2,4-dimethylphenyl)phenyl]ethanamine
PubChem CID61033767
Molecular FormulaC16H19N
Molecular Weight225.33 g/mol
Exact Mass225.15
IUPAC Name1-[4-(2,4-dimethylphenyl)phenyl]ethanamine
SMILESCc1ccc(-c2ccc(C(C)N)cc2)c(C)c1
InChIInChI=1S/C16H19N/c1-11-4-9-16(12(2)10-11)15-7-5-14(6-8-15)13(3)17/h4-10,13H,17H2,1-3H3
InChIKeyNJUQVGOCQIJROI-UHFFFAOYSA-N
XLogP3.99
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-bromophenyl)-2,4-dimethylbenzene
CID 83659015
1-[4-(2,4-dimethylphenoxy)phenyl]ethanamine
CID 43189138
1-[4-(2-fluoro-4,6-dimethylphenyl)phenyl]ethanamine
CID 106882206
N-[4-[(1R)-1-aminoethyl]phenyl]-N,2,4-trimethylaniline
CID 55190482
4-[5-(1-aminoethyl)-2-methylphenyl]phenol
CID 115036232
CID 158402729
CID 158402729
1-[4-(2-methoxy-4,6-dimethylphenyl)phenyl]ethanamine
CID 106681095
4-chloro-2-methyl-1-(4-propan-2-ylphenyl)benzene
CID 71243768
1-[4-(2,3-dimethylphenyl)phenyl]-2,4-dimethylbenzene
CID 144502475
1,6-dimethylazulene
CID 10855725
1-[3-(2,4-dimethylphenyl)phenyl]-2,4-dimethylbenzene
CID 90996196
1-[4-[2-methyl-5-(trifluoromethyl)phenyl]phenyl]ethanamine;hydrochloride
CID 168665304

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2,4-dimethylphenyl)phenyl]ethanamine?
The IUPAC name of 1-[4-(2,4-dimethylphenyl)phenyl]ethanamine (CID 61033767) is 1-[4-(2,4-dimethylphenyl)phenyl]ethanamine.
What is the SMILES notation for 1-[4-(2,4-dimethylphenyl)phenyl]ethanamine?
The canonical SMILES for 1-[4-(2,4-dimethylphenyl)phenyl]ethanamine is Cc1ccc(-c2ccc(C(C)N)cc2)c(C)c1.
What is the InChIKey of 1-[4-(2,4-dimethylphenyl)phenyl]ethanamine?
The InChIKey is NJUQVGOCQIJROI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-11-4-9-16(12(2)10-11)15-7-5-14(6-8-15)13(3)17/h4-10,13H,17H2,1-3H3.
What are the key properties of 1-[4-(2,4-dimethylphenyl)phenyl]ethanamine?
1-[4-(2,4-dimethylphenyl)phenyl]ethanamine has a molecular weight of 225.33 g/mol, XLogP of 3.99, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2,4-dimethylphenyl)phenyl]ethanamine is sourced from PubChem (CID 61033767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).