2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine

C14H23NO4 — CID 105008034

IUPAC2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine
SMILESCCOCC(NC)c1ccc(OC)c(OC)c1OC
InChIInChI=1S/C14H23NO4/c1-6-19-9-11(15-2)10-7-8-12(16-3)14(18-5)13(10)17-4/h7-8,11,15H,6,9H2,1-5H3
InChIKeyOJIFCJOPKXCGRQ-UHFFFAOYSA-N
MW269.34 g/mol
LogP2.01
Rot. Bonds8

About 2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine

2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine (PubChem CID 105008034) has the molecular formula C14H23NO4 and a molecular weight of 269.34 g/mol. Its IUPAC name is 2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine.

Molecular Properties

Compound Name2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine
PubChem CID105008034
Molecular FormulaC14H23NO4
Molecular Weight269.34 g/mol
Exact Mass269.16
IUPAC Name2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine
SMILESCCOCC(NC)c1ccc(OC)c(OC)c1OC
InChIInChI=1S/C14H23NO4/c1-6-19-9-11(15-2)10-7-8-12(16-3)14(18-5)13(10)17-4/h7-8,11,15H,6,9H2,1-5H3
InChIKeyOJIFCJOPKXCGRQ-UHFFFAOYSA-N
XLogP2.01
TPSA48.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-(2,3,4-trimethoxyphenyl)hexan-1-amine
CID 43589032
1-(3-bromo-2,4-dimethoxyphenyl)-2-ethoxy-N-ethylethanamine
CID 103523415
1-(3-chloro-4,5-dimethoxyphenyl)-2-ethoxy-N-methylethanamine
CID 79575404
[2-propan-2-yloxy-1-(2,3,4-trimethoxyphenyl)ethyl]hydrazine
CID 105323684
N,2-dimethyl-1-(2,3,4-trimethoxyphenyl)pentan-1-amine
CID 43589022
1-(2,4-dimethoxy-3-methylphenyl)-N'-ethyl-N-methylethane-1,2-diamine
CID 116950345
N-ethyl-1-(2,3,4-trimethoxyphenyl)pent-4-yn-1-amine
CID 115859372
1-(2-methoxyphenyl)-N-methyl-2-(2-propoxyethoxy)ethanamine
CID 63686193
1-(2,3-dimethoxyphenyl)-N-methylpentan-1-amine
CID 105125537
1-cyclopropyl-N-methyl-1-(2,3,4-trimethoxyphenyl)methanamine
CID 43589051
1-(dibromomethyl)-2,3,4-trimethoxybenzene
CID 87568528
N-methyl-1-(5-methylfuran-2-yl)-1-(2,3,4-trimethoxyphenyl)methanamine
CID 43589020

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine?
The IUPAC name of 2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine (CID 105008034) is 2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine.
What is the SMILES notation for 2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine?
The canonical SMILES for 2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine is CCOCC(NC)c1ccc(OC)c(OC)c1OC.
What is the InChIKey of 2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine?
The InChIKey is OJIFCJOPKXCGRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO4/c1-6-19-9-11(15-2)10-7-8-12(16-3)14(18-5)13(10)17-4/h7-8,11,15H,6,9H2,1-5H3.
What are the key properties of 2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine?
2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine has a molecular weight of 269.34 g/mol, XLogP of 2.01, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine is sourced from PubChem (CID 105008034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).