2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole

C8H13NO2 — CID 134224933

IUPAC2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole
SMILESCOc1nc(C)c(C(C)C)o1
InChIInChI=1S/C8H13NO2/c1-5(2)7-6(3)9-8(10-4)11-7/h5H,1-4H3
InChIKeySZXSEEKKSXACPK-UHFFFAOYSA-N
MW155.20 g/mol
LogP2.12
Rot. Bonds2

About 2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole

2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole (PubChem CID 134224933) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is 2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole.

Molecular Properties

Compound Name2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole
PubChem CID134224933
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole
SMILESCOc1nc(C)c(C(C)C)o1
InChIInChI=1S/C8H13NO2/c1-5(2)7-6(3)9-8(10-4)11-7/h5H,1-4H3
InChIKeySZXSEEKKSXACPK-UHFFFAOYSA-N
XLogP2.12
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole?
The IUPAC name of 2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole (CID 134224933) is 2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole.
What is the SMILES notation for 2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole?
The canonical SMILES for 2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole is COc1nc(C)c(C(C)C)o1.
What is the InChIKey of 2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole?
The InChIKey is SZXSEEKKSXACPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-5(2)7-6(3)9-8(10-4)11-7/h5H,1-4H3.
What are the key properties of 2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole?
2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole has a molecular weight of 155.20 g/mol, XLogP of 2.12, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-methyl-5-propan-2-yl-1,3-oxazole is sourced from PubChem (CID 134224933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).