N-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline

C18H23N — CID 43096079

IUPACN-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline
SMILESCCc1ccccc1NC(C)c1ccc(C)cc1C
InChIInChI=1S/C18H23N/c1-5-16-8-6-7-9-18(16)19-15(4)17-11-10-13(2)12-14(17)3/h6-12,15,19H,5H2,1-4H3
InChIKeyBYWWQXGXQATGLU-UHFFFAOYSA-N
MW253.39 g/mol
LogP5.04
Rot. Bonds4

About N-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline

N-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline (PubChem CID 43096079) has the molecular formula C18H23N and a molecular weight of 253.39 g/mol. Its IUPAC name is N-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline.

Molecular Properties

Compound NameN-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline
PubChem CID43096079
Molecular FormulaC18H23N
Molecular Weight253.39 g/mol
Exact Mass253.18
IUPAC NameN-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline
SMILESCCc1ccccc1NC(C)c1ccc(C)cc1C
InChIInChI=1S/C18H23N/c1-5-16-8-6-7-9-18(16)19-15(4)17-11-10-13(2)12-14(17)3/h6-12,15,19H,5H2,1-4H3
InChIKeyBYWWQXGXQATGLU-UHFFFAOYSA-N
XLogP5.04
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500253.39
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[2-[1-(2,4-dimethylphenyl)ethylamino]phenyl]acetamide
CID 43738545
4-[1-(2-ethylanilino)ethyl]benzene-1,3-diol
CID 43195633
2-[2-[1-(2,5-dimethylphenyl)ethylamino]phenyl]acetamide
CID 43738423
2-(difluoromethoxy)-N-[1-(2,4-dimethylphenyl)ethyl]aniline
CID 43096414
N-[1-(2,4-dimethylphenyl)ethyl]-4-ethylaniline
CID 43098508
1-N,1-N'-bis(2-ethylphenyl)ethane-1,1-diamine
CID 129291272
2-bromo-3-chloro-N-[1-(2,4-dimethylphenyl)ethyl]aniline
CID 103477851
2-ethyl-N-[1-(2-fluoro-4-methoxyphenyl)ethyl]aniline
CID 43764537
[2-[1-(2-methylphenyl)ethylamino]phenyl]methanol
CID 43743253
N-(2-ethylphenyl)-2,4-dimethylbenzamide
CID 953221
N-[1-(2,4-dimethylphenyl)ethyl]-5-fluoro-2-methylaniline
CID 43094302
2-[1-[2-(2-methoxyethyl)anilino]ethyl]-5-methylphenol
CID 102848911

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline?
The IUPAC name of N-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline (CID 43096079) is N-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline.
What is the SMILES notation for N-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline?
The canonical SMILES for N-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline is CCc1ccccc1NC(C)c1ccc(C)cc1C.
What is the InChIKey of N-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline?
The InChIKey is BYWWQXGXQATGLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N/c1-5-16-8-6-7-9-18(16)19-15(4)17-11-10-13(2)12-14(17)3/h6-12,15,19H,5H2,1-4H3.
What are the key properties of N-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline?
N-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline has a molecular weight of 253.39 g/mol, XLogP of 5.04, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,4-dimethylphenyl)ethyl]-2-ethylaniline is sourced from PubChem (CID 43096079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).