2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile

C10H8N4O — CID 121206735

IUPAC2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile
SMILESCc1nc(C#N)cc(-c2cnoc2C)n1
InChIInChI=1S/C10H8N4O/c1-6-9(5-12-15-6)10-3-8(4-11)13-7(2)14-10/h3,5H,1-2H3
InChIKeyRAJFWEDHPUABJE-UHFFFAOYSA-N
MW200.20 g/mol
LogP1.62
Rot. Bonds1

About 2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile

2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile (PubChem CID 121206735) has the molecular formula C10H8N4O and a molecular weight of 200.20 g/mol. Its IUPAC name is 2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile.

Molecular Properties

Compound Name2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile
PubChem CID121206735
Molecular FormulaC10H8N4O
Molecular Weight200.20 g/mol
Exact Mass200.07
IUPAC Name2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile
SMILESCc1nc(C#N)cc(-c2cnoc2C)n1
InChIInChI=1S/C10H8N4O/c1-6-9(5-12-15-6)10-3-8(4-11)13-7(2)14-10/h3,5H,1-2H3
InChIKeyRAJFWEDHPUABJE-UHFFFAOYSA-N
XLogP1.62
TPSA75.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.20
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile 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-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile?
The IUPAC name of 2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile (CID 121206735) is 2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile.
What is the SMILES notation for 2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile?
The canonical SMILES for 2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile is Cc1nc(C#N)cc(-c2cnoc2C)n1.
What is the InChIKey of 2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile?
The InChIKey is RAJFWEDHPUABJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O/c1-6-9(5-12-15-6)10-3-8(4-11)13-7(2)14-10/h3,5H,1-2H3.
What are the key properties of 2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile?
2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile has a molecular weight of 200.20 g/mol, XLogP of 1.62, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(5-methyl-1,2-oxazol-4-yl)pyrimidine-4-carbonitrile is sourced from PubChem (CID 121206735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).