3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine

C19H25NO3 — CID 83974436

IUPAC3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine
SMILESCCOc1ccccc1C(CN)Cc1ccc(OC)cc1OC
InChIInChI=1S/C19H25NO3/c1-4-23-18-8-6-5-7-17(18)15(13-20)11-14-9-10-16(21-2)12-19(14)22-3/h5-10,12,15H,4,11,13,20H2,1-3H3
InChIKeyAXQMEJALEUJCEO-UHFFFAOYSA-N
MW315.41 g/mol
LogP3.39
Rot. Bonds8

About 3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine

3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine (PubChem CID 83974436) has the molecular formula C19H25NO3 and a molecular weight of 315.41 g/mol. Its IUPAC name is 3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine.

Molecular Properties

Compound Name3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine
PubChem CID83974436
Molecular FormulaC19H25NO3
Molecular Weight315.41 g/mol
Exact Mass315.18
IUPAC Name3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine
SMILESCCOc1ccccc1C(CN)Cc1ccc(OC)cc1OC
InChIInChI=1S/C19H25NO3/c1-4-23-18-8-6-5-7-17(18)15(13-20)11-14-9-10-16(21-2)12-19(14)22-3/h5-10,12,15H,4,11,13,20H2,1-3H3
InChIKeyAXQMEJALEUJCEO-UHFFFAOYSA-N
XLogP3.39
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.41
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2,4-diethoxyphenyl)-2-(2-methoxyphenyl)propan-1-amine
CID 83974368
3-(2,4-diethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine
CID 83974449
3-(2,4-dimethoxyphenyl)-2-(3,5-dimethylphenyl)propan-1-amine
CID 83977036
(2,5-dimethoxyphenyl)-(2-ethoxyphenyl)methanamine
CID 43197204
3-(2,3-dichlorophenyl)-2-(2,4-dimethoxyphenyl)propan-1-amine
CID 83973145
2-(2,5-dimethoxyphenyl)-3-(5-ethyl-2-methoxyphenyl)propan-1-amine
CID 82141576
3-(3-butoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine
CID 83974462
3-(2,4-diethoxyphenyl)-2-(1H-indol-3-yl)propan-1-amine
CID 83976344
3-(2,4-diethoxyphenyl)-2-(2,5-dimethylphenyl)propan-1-amine
CID 83972953
3-(2-ethoxy-3-methoxyphenyl)-2-(4-methoxyphenyl)propan-1-amine
CID 83972548
3-(2,3-diethoxyphenyl)-2-(5-fluoro-2-methoxyphenyl)propan-1-amine
CID 112538999
3-(3-butoxy-4-methoxyphenyl)-2-(2-methoxyphenyl)propan-1-amine
CID 83974356

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine?
The IUPAC name of 3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine (CID 83974436) is 3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine.
What is the SMILES notation for 3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine?
The canonical SMILES for 3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine is CCOc1ccccc1C(CN)Cc1ccc(OC)cc1OC.
What is the InChIKey of 3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine?
The InChIKey is AXQMEJALEUJCEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO3/c1-4-23-18-8-6-5-7-17(18)15(13-20)11-14-9-10-16(21-2)12-19(14)22-3/h5-10,12,15H,4,11,13,20H2,1-3H3.
What are the key properties of 3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine?
3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine has a molecular weight of 315.41 g/mol, XLogP of 3.39, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dimethoxyphenyl)-2-(2-ethoxyphenyl)propan-1-amine is sourced from PubChem (CID 83974436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).