2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine

C19H25NO — CID 62553312

IUPAC2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine
SMILESCCOc1ccc(C(Cc2ccc(C)c(C)c2)NC)cc1
InChIInChI=1S/C19H25NO/c1-5-21-18-10-8-17(9-11-18)19(20-4)13-16-7-6-14(2)15(3)12-16/h6-12,19-20H,5,13H2,1-4H3
InChIKeyFFUVRPGEZVDQAL-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.21
Rot. Bonds6

About 2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine

2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine (PubChem CID 62553312) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine.

Molecular Properties

Compound Name2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine
PubChem CID62553312
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine
SMILESCCOc1ccc(C(Cc2ccc(C)c(C)c2)NC)cc1
InChIInChI=1S/C19H25NO/c1-5-21-18-10-8-17(9-11-18)19(20-4)13-16-7-6-14(2)15(3)12-16/h6-12,19-20H,5,13H2,1-4H3
InChIKeyFFUVRPGEZVDQAL-UHFFFAOYSA-N
XLogP4.21
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chlorophenyl)-2-(3,4-dimethylphenyl)-N-methylethanamine
CID 63414512
2-(3-bromo-4-fluorophenyl)-1-(4-ethoxyphenyl)-N-methylethanamine
CID 115818655
[2-(3,4-dimethylphenyl)-1-(4-methoxyphenyl)ethyl]hydrazine
CID 105190875
1-(3-chloro-4-fluorophenyl)-2-(3,4-dimethylphenyl)-N-methylethanamine
CID 63418793
1-(2,3-dihydro-1H-inden-5-yl)-2-(3,4-dimethylphenyl)-N-methylethanamine
CID 63507191
1-(4-ethoxyphenyl)-2-(1-ethylpyrazol-4-yl)-N-methylethanamine
CID 115822526
1-(4-ethoxyphenyl)-N-methyl-1-(2,4,5-trimethylphenyl)methanamine
CID 104990532
1-(2,3-difluoro-4-methylphenyl)-2-(3,4-dimethylphenyl)-N-methylethanamine
CID 107513318
2-(3,4-dimethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
CID 115374488
1-(3-bromophenyl)-2-(3,4-dimethylphenyl)-N-methylethanamine
CID 63412697
2-(cyclohexen-1-yl)-1-(4-ethoxyphenyl)-N-methylethanamine
CID 116661553
1-(3,4-dimethylphenyl)-2-(3,5-dimethylphenyl)-N-methylethanamine
CID 63416604

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine?
The IUPAC name of 2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine (CID 62553312) is 2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine.
What is the SMILES notation for 2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine?
The canonical SMILES for 2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine is CCOc1ccc(C(Cc2ccc(C)c(C)c2)NC)cc1.
What is the InChIKey of 2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine?
The InChIKey is FFUVRPGEZVDQAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-5-21-18-10-8-17(9-11-18)19(20-4)13-16-7-6-14(2)15(3)12-16/h6-12,19-20H,5,13H2,1-4H3.
What are the key properties of 2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine?
2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine has a molecular weight of 283.42 g/mol, XLogP of 4.21, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenyl)-1-(4-ethoxyphenyl)-N-methylethanamine is sourced from PubChem (CID 62553312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).