3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine

C11H11BrN2O2 — CID 82134756

IUPAC3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine
SMILESCOc1ccc(Br)cc1-c1noc(N)c1C
InChIInChI=1S/C11H11BrN2O2/c1-6-10(14-16-11(6)13)8-5-7(12)3-4-9(8)15-2/h3-5H,13H2,1-2H3
InChIKeyOWILPVQESBWEMN-UHFFFAOYSA-N
MW283.12 g/mol
LogP3.00
Rot. Bonds2

About 3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine

3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine (PubChem CID 82134756) has the molecular formula C11H11BrN2O2 and a molecular weight of 283.12 g/mol. Its IUPAC name is 3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine
PubChem CID82134756
Molecular FormulaC11H11BrN2O2
Molecular Weight283.12 g/mol
Exact Mass282.00
IUPAC Name3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine
SMILESCOc1ccc(Br)cc1-c1noc(N)c1C
InChIInChI=1S/C11H11BrN2O2/c1-6-10(14-16-11(6)13)8-5-7(12)3-4-9(8)15-2/h3-5H,13H2,1-2H3
InChIKeyOWILPVQESBWEMN-UHFFFAOYSA-N
XLogP3.00
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.12
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-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

3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine
CID 62505613
4-(5-bromo-2-methoxyphenyl)-2-methyl-1,3-thiazol-5-amine
CID 62082556
3-(2,6-dimethoxyphenyl)-4-methyl-1,2-oxazol-5-amine
CID 43158389
3-(5-bromo-2-methoxyphenyl)-5-propyl-1,2-oxazole
CID 152764725
4-ethyl-3-(2-methoxy-5-methylphenyl)-1,2-oxazol-5-amine
CID 62505793
5-(5-bromo-2-methoxyphenyl)-4-propan-2-yl-1,2-oxazol-3-amine
CID 112742090
3-(5-bromo-2-methylphenyl)-4-(4-methoxyphenyl)-1,2-oxazol-5-amine;ethane
CID 144602769
2-(5-bromo-2-methoxyphenyl)-4,5-dimethyl-1,3-oxazole
CID 82489419
5-bromo-4-(5-bromo-2-methoxyphenyl)-6-chloropyrimidin-2-amine
CID 24946892
5-(5-bromo-2-methoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine
CID 62224005
4-(5-bromo-2-methoxyphenyl)-N,5-dimethyl-1,3-oxazol-2-amine
CID 116832589
2-(5-bromo-2-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
CID 63617266

Frequently Asked Questions

What is the IUPAC name of 3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine?
The IUPAC name of 3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine (CID 82134756) is 3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine?
The canonical SMILES for 3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine is COc1ccc(Br)cc1-c1noc(N)c1C.
What is the InChIKey of 3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine?
The InChIKey is OWILPVQESBWEMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2O2/c1-6-10(14-16-11(6)13)8-5-7(12)3-4-9(8)15-2/h3-5H,13H2,1-2H3.
What are the key properties of 3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine?
3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine has a molecular weight of 283.12 g/mol, XLogP of 3.00, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine is sourced from PubChem (CID 82134756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).