3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole

C14H14N4O — CID 138115339

IUPAC3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole
SMILESCc1noc(C)c1-c1ncn(C)c1-c1ccncc1
InChIInChI=1S/C14H14N4O/c1-9-12(10(2)19-17-9)13-14(18(3)8-16-13)11-4-6-15-7-5-11/h4-8H,1-3H3
InChIKeyXPQAEPLMWBAUIW-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.75
Rot. Bonds2

About 3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole

3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole (PubChem CID 138115339) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole.

Molecular Properties

Compound Name3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole
PubChem CID138115339
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole
SMILESCc1noc(C)c1-c1ncn(C)c1-c1ccncc1
InChIInChI=1S/C14H14N4O/c1-9-12(10(2)19-17-9)13-14(18(3)8-16-13)11-4-6-15-7-5-11/h4-8H,1-3H3
InChIKeyXPQAEPLMWBAUIW-UHFFFAOYSA-N
XLogP2.75
TPSA56.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-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 3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole?
The IUPAC name of 3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole (CID 138115339) is 3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole.
What is the SMILES notation for 3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole?
The canonical SMILES for 3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole is Cc1noc(C)c1-c1ncn(C)c1-c1ccncc1.
What is the InChIKey of 3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole?
The InChIKey is XPQAEPLMWBAUIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c1-9-12(10(2)19-17-9)13-14(18(3)8-16-13)11-4-6-15-7-5-11/h4-8H,1-3H3.
What are the key properties of 3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole?
3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole has a molecular weight of 254.29 g/mol, XLogP of 2.75, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-4-(1-methyl-5-pyridin-4-ylimidazol-4-yl)-1,2-oxazole is sourced from PubChem (CID 138115339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).