[4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine

C12H14N2O3 — CID 82129188

IUPAC[4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine
SMILESCOc1ccc(-c2ncoc2CN)c(OC)c1
InChIInChI=1S/C12H14N2O3/c1-15-8-3-4-9(10(5-8)16-2)12-11(6-13)17-7-14-12/h3-5,7H,6,13H2,1-2H3
InChIKeyHYJOBAXJUDYSBT-UHFFFAOYSA-N
MW234.25 g/mol
LogP1.82
Rot. Bonds4

About [4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine

[4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine (PubChem CID 82129188) has the molecular formula C12H14N2O3 and a molecular weight of 234.25 g/mol. Its IUPAC name is [4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine.

Molecular Properties

Compound Name[4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine
PubChem CID82129188
Molecular FormulaC12H14N2O3
Molecular Weight234.25 g/mol
Exact Mass234.10
IUPAC Name[4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine
SMILESCOc1ccc(-c2ncoc2CN)c(OC)c1
InChIInChI=1S/C12H14N2O3/c1-15-8-3-4-9(10(5-8)16-2)12-11(6-13)17-7-14-12/h3-5,7H,6,13H2,1-2H3
InChIKeyHYJOBAXJUDYSBT-UHFFFAOYSA-N
XLogP1.82
TPSA70.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine 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

[4-(4-methoxy-2,5-dimethylphenyl)-1,3-oxazol-5-yl]methanamine
CID 82128869
[4-(3-bromo-4-methoxyphenyl)-1,3-oxazol-5-yl]methanamine
CID 82134755
2-[4-(2,4-dimethoxyphenyl)-1H-imidazol-5-yl]ethanamine
CID 39101589
1-[2-(2,4-dimethoxyphenyl)phenyl]-2,4-dimethoxybenzene
CID 70200625
[4-(2,4-dimethoxyphenyl)-3-methylphenyl]methanamine
CID 66479632
2-(2,4-dimethoxyphenyl)-3-methoxypyridin-4-amine
CID 77093303
N-[[5-(2,4-dimethoxyphenyl)-1,3-oxazol-4-yl]methyl]-2-methylpropan-1-amine
CID 79147753
4-(2,4-dimethoxyphenyl)-2,6-dimethylpyrimidin-5-amine
CID 82484014
[2-(2,4-dimethoxyphenyl)-4-methyl-1,3-thiazol-5-yl]methanamine
CID 82133642
[3-(2-fluoro-4-methoxyphenyl)furan-2-yl]methanamine
CID 106887847
[3-(2,5-dimethoxyphenyl)pyrazin-2-yl]methanamine
CID 82478923
[4-bromo-2-(2,4-dimethoxyphenyl)-1,3-thiazol-5-yl]methanamine
CID 84608613

Frequently Asked Questions

What is the IUPAC name of [4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine?
The IUPAC name of [4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine (CID 82129188) is [4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine.
What is the SMILES notation for [4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine?
The canonical SMILES for [4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine is COc1ccc(-c2ncoc2CN)c(OC)c1.
What is the InChIKey of [4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine?
The InChIKey is HYJOBAXJUDYSBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O3/c1-15-8-3-4-9(10(5-8)16-2)12-11(6-13)17-7-14-12/h3-5,7H,6,13H2,1-2H3.
What are the key properties of [4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine?
[4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine has a molecular weight of 234.25 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,4-dimethoxyphenyl)-1,3-oxazol-5-yl]methanamine is sourced from PubChem (CID 82129188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).