2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine

C14H23NO2 — CID 112512308

IUPAC2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine
SMILESCCOc1cc(C)c(C(CNC)OC)cc1C
InChIInChI=1S/C14H23NO2/c1-6-17-13-8-10(2)12(7-11(13)3)14(16-5)9-15-4/h7-8,14-15H,6,9H2,1-5H3
InChIKeyGXNGBTVKPUHQRF-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.61
Rot. Bonds6

About 2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine

2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine (PubChem CID 112512308) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine.

Molecular Properties

Compound Name2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine
PubChem CID112512308
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine
SMILESCCOc1cc(C)c(C(CNC)OC)cc1C
InChIInChI=1S/C14H23NO2/c1-6-17-13-8-10(2)12(7-11(13)3)14(16-5)9-15-4/h7-8,14-15H,6,9H2,1-5H3
InChIKeyGXNGBTVKPUHQRF-UHFFFAOYSA-N
XLogP2.61
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-ethoxy-2,5-dimethylphenyl)-N-methylbutan-1-amine
CID 112508260
2-(2,5-dimethoxy-4-methylphenyl)-2-methoxy-N-methylethanamine
CID 112512367
2-(4-ethoxy-3-fluorophenyl)-2-methoxy-N-methylethanamine
CID 112512177
1-(4-ethoxy-2,5-dimethylphenyl)-2-(propan-2-ylamino)ethanol
CID 112510507
1-(4-ethoxy-2,5-dimethylphenyl)ethane-1,2-diol
CID 82284052
2-(4-ethoxy-2,5-dimethylphenyl)-2-(ethylamino)ethanol
CID 112512309
methyl 4-(4-ethoxy-2,5-dimethylphenyl)-4-hydroxy-3-(methylamino)butanoate
CID 82350072
2-methoxy-2-(2-methoxyphenyl)-N-methylethanamine
CID 53276193
1-(4-ethoxy-2,5-dimethylphenyl)-N,N-dimethylpropane-1,3-diamine
CID 112518773
1-(4-ethoxy-2,5-dimethylphenyl)-2-(ethylamino)propan-1-ol
CID 112512601
2-[(4-ethoxy-3-methylphenyl)methyl]-N-methylbutan-1-amine
CID 116931822
1-ethoxy-4-ethyl-2,5-dimethylbenzene
CID 84761080

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine?
The IUPAC name of 2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine (CID 112512308) is 2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine.
What is the SMILES notation for 2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine?
The canonical SMILES for 2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine is CCOc1cc(C)c(C(CNC)OC)cc1C.
What is the InChIKey of 2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine?
The InChIKey is GXNGBTVKPUHQRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-6-17-13-8-10(2)12(7-11(13)3)14(16-5)9-15-4/h7-8,14-15H,6,9H2,1-5H3.
What are the key properties of 2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine?
2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine has a molecular weight of 237.34 g/mol, XLogP of 2.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxy-2,5-dimethylphenyl)-2-methoxy-N-methylethanamine is sourced from PubChem (CID 112512308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).