4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline

C19H25N — CID 43109583

IUPAC4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline
SMILESCCc1ccc(NC(C)c2c(C)cc(C)cc2C)cc1
InChIInChI=1S/C19H25N/c1-6-17-7-9-18(10-8-17)20-16(5)19-14(3)11-13(2)12-15(19)4/h7-12,16,20H,6H2,1-5H3
InChIKeyLEQZOWPALLNECF-UHFFFAOYSA-N
MW267.42 g/mol
LogP5.35
Rot. Bonds4

About 4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline

4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline (PubChem CID 43109583) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is 4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline.

Molecular Properties

Compound Name4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline
PubChem CID43109583
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Name4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline
SMILESCCc1ccc(NC(C)c2c(C)cc(C)cc2C)cc1
InChIInChI=1S/C19H25N/c1-6-17-7-9-18(10-8-17)20-16(5)19-14(3)11-13(2)12-15(19)4/h7-12,16,20H,6H2,1-5H3
InChIKeyLEQZOWPALLNECF-UHFFFAOYSA-N
XLogP5.35
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500267.42
LogP ≤ 55.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-propyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline
CID 43107132
N-[1-(2,4-dimethylphenyl)ethyl]-4-ethylaniline
CID 43098508
4-chloro-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline
CID 43103984
N-[4-[1-(2,4,6-trimethylphenyl)ethylamino]phenyl]acetamide
CID 43824765
2-(4-ethylphenyl)-N-methyl-1-(2,4,6-trimethylphenyl)ethanamine
CID 115803077
4-ethyl-N-[1-(2-methoxy-4-methylphenyl)ethyl]aniline
CID 43764329
N-[1-(4-ethylphenyl)ethyl]-3-fluoro-5-methylaniline
CID 79054943
2-(4-ethylphenyl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 115803358
4-ethyl-N-(1-pyridin-4-ylethyl)aniline
CID 43195541
N-(2,4-dimethylphenyl)-2-(4-ethylanilino)propanamide
CID 46757541
N-[1-(4-ethylphenyl)ethyl]aniline
CID 43190038
3-methoxy-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline
CID 43106119

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline?
The IUPAC name of 4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline (CID 43109583) is 4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline.
What is the SMILES notation for 4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline?
The canonical SMILES for 4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline is CCc1ccc(NC(C)c2c(C)cc(C)cc2C)cc1.
What is the InChIKey of 4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline?
The InChIKey is LEQZOWPALLNECF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-6-17-7-9-18(10-8-17)20-16(5)19-14(3)11-13(2)12-15(19)4/h7-12,16,20H,6H2,1-5H3.
What are the key properties of 4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline?
4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline has a molecular weight of 267.42 g/mol, XLogP of 5.35, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]aniline is sourced from PubChem (CID 43109583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).