1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine

C20H27N — CID 115803668

IUPAC1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine
SMILESCCNC(Cc1ccc(CC)cc1)c1ccc(C)cc1C
InChIInChI=1S/C20H27N/c1-5-17-8-10-18(11-9-17)14-20(21-6-2)19-12-7-15(3)13-16(19)4/h7-13,20-21H,5-6,14H2,1-4H3
InChIKeyLYZPJOPCSBPCSL-UHFFFAOYSA-N
MW281.44 g/mol
LogP4.76
Rot. Bonds6

About 1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine

1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine (PubChem CID 115803668) has the molecular formula C20H27N and a molecular weight of 281.44 g/mol. Its IUPAC name is 1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine.

Molecular Properties

Compound Name1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine
PubChem CID115803668
Molecular FormulaC20H27N
Molecular Weight281.44 g/mol
Exact Mass281.21
IUPAC Name1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine
SMILESCCNC(Cc1ccc(CC)cc1)c1ccc(C)cc1C
InChIInChI=1S/C20H27N/c1-5-17-8-10-18(11-9-17)14-20(21-6-2)19-12-7-15(3)13-16(19)4/h7-13,20-21H,5-6,14H2,1-4H3
InChIKeyLYZPJOPCSBPCSL-UHFFFAOYSA-N
XLogP4.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-2-(4-ethylphenyl)-1-(4-fluoro-2-methylphenyl)ethanamine
CID 81269216
N-[(2,4-dimethylphenyl)-(4-ethylphenyl)methyl]ethanamine
CID 43489966
1-(2,4-dimethylphenyl)-N-ethyl-2-(2-methylphenyl)ethanamine
CID 43489975
1-(2,4-dimethylphenyl)-N,3-diethylpentan-1-amine
CID 105028376
1-(2,4-dimethylphenyl)-N-ethyl-2-propylsulfanylethanamine
CID 64614075
1-(4-bromo-2-methylphenyl)-N-ethyl-2-(4-fluorophenyl)ethanamine
CID 63527393
2-(3,4-difluorophenyl)-N-ethyl-1-(4-fluoro-2-methylphenyl)ethanamine
CID 82910596
2-(2-bromo-5-fluorophenyl)-1-(2,4-dimethylphenyl)-N-ethylethanamine
CID 115843807
1-(2,4-dimethylphenyl)-N-ethyl-2-ethylsulfonylethanamine
CID 64647574
1-(2,4-dimethylphenyl)-N-ethyl-3,3,3-trifluoropropan-1-amine
CID 43490017
2-(4-chlorophenyl)-N-ethyl-1-(2-fluoro-5-methylphenyl)ethanamine
CID 63412865
N-ethyl-2-(4-ethylphenyl)-1-(4-methyl-2-pyridinyl)ethanamine
CID 63841394

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine?
The IUPAC name of 1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine (CID 115803668) is 1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine.
What is the SMILES notation for 1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine?
The canonical SMILES for 1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine is CCNC(Cc1ccc(CC)cc1)c1ccc(C)cc1C.
What is the InChIKey of 1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine?
The InChIKey is LYZPJOPCSBPCSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N/c1-5-17-8-10-18(11-9-17)14-20(21-6-2)19-12-7-15(3)13-16(19)4/h7-13,20-21H,5-6,14H2,1-4H3.
What are the key properties of 1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine?
1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine has a molecular weight of 281.44 g/mol, XLogP of 4.76, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylphenyl)-N-ethyl-2-(4-ethylphenyl)ethanamine is sourced from PubChem (CID 115803668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).