1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine

C14H23NO2 — CID 43626772

IUPAC1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine
SMILESCCNC(CC)c1cc(OC)c(OC)cc1C
InChIInChI=1S/C14H23NO2/c1-6-12(15-7-2)11-9-14(17-5)13(16-4)8-10(11)3/h8-9,12,15H,6-7H2,1-5H3
InChIKeyZJQNMZHMLSOVNG-UHFFFAOYSA-N
MW237.34 g/mol
LogP3.07
Rot. Bonds6

About 1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine

1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine (PubChem CID 43626772) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine.

Molecular Properties

Compound Name1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine
PubChem CID43626772
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine
SMILESCCNC(CC)c1cc(OC)c(OC)cc1C
InChIInChI=1S/C14H23NO2/c1-6-12(15-7-2)11-9-14(17-5)13(16-4)8-10(11)3/h8-9,12,15H,6-7H2,1-5H3
InChIKeyZJQNMZHMLSOVNG-UHFFFAOYSA-N
XLogP3.07
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 ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2,5-dimethoxy-4-methylphenyl)-2-(ethylamino)ethanol
CID 112512368
1-(1-bromopropyl)-4,5-dimethoxy-2-methylbenzene
CID 61097408
1-(3,4-dimethoxyphenyl)-N-ethylpropan-1-amine
CID 43200497
1-(2,5-dimethoxyphenyl)-N-ethylpropan-1-amine
CID 43489494
1-(2,5-dimethylphenyl)-N-ethylpropan-1-amine
CID 43490783
1-(4,5-dimethoxy-2-methylphenyl)-N-methyloctan-1-amine
CID 43626724
1-(4,5-dimethoxy-2-methylphenyl)-N,4-dimethylpentan-1-amine
CID 43626705
1-(4,5-dimethoxy-2-methylphenyl)-N'-ethylethane-1,2-diamine
CID 116934918
1-(4,5-dimethoxy-2-methylphenyl)-N,N'-dimethylpropane-1,3-diamine
CID 116948581
N-ethyl-1-(4-methoxy-2,5-dimethylphenyl)-2-(thian-4-yl)ethanamine
CID 105179151
N-[(4,5-dimethoxy-2-methylphenyl)-(2-methylcyclopentyl)methyl]ethanamine
CID 107177620
1-(5-bromo-2-methoxy-4-methylphenyl)-N-propylpropan-1-amine
CID 65433156

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine?
The IUPAC name of 1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine (CID 43626772) is 1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine.
What is the SMILES notation for 1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine?
The canonical SMILES for 1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine is CCNC(CC)c1cc(OC)c(OC)cc1C.
What is the InChIKey of 1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine?
The InChIKey is ZJQNMZHMLSOVNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-6-12(15-7-2)11-9-14(17-5)13(16-4)8-10(11)3/h8-9,12,15H,6-7H2,1-5H3.
What are the key properties of 1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine?
1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine has a molecular weight of 237.34 g/mol, XLogP of 3.07, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dimethoxy-2-methylphenyl)-N-ethylpropan-1-amine is sourced from PubChem (CID 43626772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).