5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine

C12H14N2O3 — CID 82290583

IUPAC5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine
SMILESCOc1cc(-c2cnc(N)o2)c(OC)cc1C
InChIInChI=1S/C12H14N2O3/c1-7-4-10(16-3)8(5-9(7)15-2)11-6-14-12(13)17-11/h4-6H,1-3H3,(H2,13,14)
InChIKeyHAYPDWCNBODEJQ-UHFFFAOYSA-N
MW234.25 g/mol
LogP2.25
Rot. Bonds3

About 5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine

5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine (PubChem CID 82290583) has the molecular formula C12H14N2O3 and a molecular weight of 234.25 g/mol. Its IUPAC name is 5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine.

Molecular Properties

Compound Name5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine
PubChem CID82290583
Molecular FormulaC12H14N2O3
Molecular Weight234.25 g/mol
Exact Mass234.10
IUPAC Name5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine
SMILESCOc1cc(-c2cnc(N)o2)c(OC)cc1C
InChIInChI=1S/C12H14N2O3/c1-7-4-10(16-3)8(5-9(7)15-2)11-6-14-12(13)17-11/h4-6H,1-3H3,(H2,13,14)
InChIKeyHAYPDWCNBODEJQ-UHFFFAOYSA-N
XLogP2.25
TPSA70.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[5-(2,4,5-trimethoxyphenyl)-1,3-oxazol-2-yl]methanamine
CID 65179670
5-(5-ethoxy-2-methoxy-4-methylphenyl)-1,2-oxazol-3-amine
CID 117373528
5-(2,3,4-trimethylphenyl)-1,3-oxazol-2-amine
CID 116832317
5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine
CID 82287443
5-(3-ethyl-4-methoxyphenyl)-1,3-oxazol-2-amine
CID 82285421
N-[[5-(2,4,5-trimethoxyphenyl)-1,3-oxazol-2-yl]methyl]ethanamine
CID 65178890
6-(2,5-dimethoxy-4-methylphenyl)pyridazin-3-amine
CID 82478943
5-[2-methoxy-5-(2-methoxyphenyl)phenyl]-1,3-oxazol-2-amine;2,2,2-trifluoroacetic acid
CID 121231725
1,4-dimethoxy-2,5-dimethylbenzene;dihydrochloride
CID 172845974
5-(2,5-dimethoxy-4-methylphenyl)-1-methylpyrazole
CID 116869159
3-(2,5-dimethoxy-4-methylphenyl)-5-methyl-1H-pyrazol-4-amine
CID 82479888
2-[(4-methoxy-2,5-dimethylphenyl)methyl]pyrimidin-5-amine
CID 82293774

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine?
The IUPAC name of 5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine (CID 82290583) is 5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine.
What is the SMILES notation for 5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine?
The canonical SMILES for 5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine is COc1cc(-c2cnc(N)o2)c(OC)cc1C.
What is the InChIKey of 5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine?
The InChIKey is HAYPDWCNBODEJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O3/c1-7-4-10(16-3)8(5-9(7)15-2)11-6-14-12(13)17-11/h4-6H,1-3H3,(H2,13,14).
What are the key properties of 5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine?
5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine has a molecular weight of 234.25 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine is sourced from PubChem (CID 82290583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).