2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine

C19H25NO — CID 63476135

IUPAC2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine
SMILESCNC(COc1cc(C)ccc1C)c1cc(C)ccc1C
InChIInChI=1S/C19H25NO/c1-13-6-8-15(3)17(10-13)18(20-5)12-21-19-11-14(2)7-9-16(19)4/h6-11,18,20H,12H2,1-5H3
InChIKeyZKWSIIRVVLFEMR-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.26
Rot. Bonds5

About 2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine

2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine (PubChem CID 63476135) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine.

Molecular Properties

Compound Name2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine
PubChem CID63476135
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine
SMILESCNC(COc1cc(C)ccc1C)c1cc(C)ccc1C
InChIInChI=1S/C19H25NO/c1-13-6-8-15(3)17(10-13)18(20-5)12-21-19-11-14(2)7-9-16(19)4/h6-11,18,20H,12H2,1-5H3
InChIKeyZKWSIIRVVLFEMR-UHFFFAOYSA-N
XLogP4.26
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloro-4-methylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine
CID 63500567
1-(2,5-dimethylphenyl)-N-methylpropan-1-amine
CID 43483756
2-(2-chloro-4-methylphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine
CID 62670922
(2S)-2-(2,5-dimethylphenyl)-2-(methylamino)ethanol
CID 55276234
N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine
CID 63473491
3-(2,5-dimethylphenyl)-3-(methylamino)propan-1-ol
CID 64812187
1-(2,5-dimethylphenyl)-N-methylpentan-1-amine
CID 43483753
N-methyl-1-(4-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine
CID 63474209
1-(2,5-dimethylphenyl)-N-methyl-3-propoxypropan-1-amine
CID 105120142
1-(3,5-dimethylphenyl)-2-(5-fluoro-2-methylphenoxy)-N-methylethanamine
CID 102981071
1-(2,5-dimethylphenyl)-N-methyl-3-(4-methylphenyl)propan-1-amine
CID 105120019
1-(2,5-dimethylphenyl)-N-methyl-3-(3-methylphenoxy)propan-1-amine
CID 105120506

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine?
The IUPAC name of 2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine (CID 63476135) is 2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine.
What is the SMILES notation for 2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine?
The canonical SMILES for 2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine is CNC(COc1cc(C)ccc1C)c1cc(C)ccc1C.
What is the InChIKey of 2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine?
The InChIKey is ZKWSIIRVVLFEMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-13-6-8-15(3)17(10-13)18(20-5)12-21-19-11-14(2)7-9-16(19)4/h6-11,18,20H,12H2,1-5H3.
What are the key properties of 2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine?
2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine has a molecular weight of 283.42 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenoxy)-1-(2,5-dimethylphenyl)-N-methylethanamine is sourced from PubChem (CID 63476135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).