4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine

C11H14N4O3 — CID 12771929

IUPAC4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine
SMILESCOc1cc(OC)nc(-n2nc(C)cc2OC)n1
InChIInChI=1S/C11H14N4O3/c1-7-5-10(18-4)15(14-7)11-12-8(16-2)6-9(13-11)17-3/h5-6H,1-4H3
InChIKeyMTIDKMZISJDILC-UHFFFAOYSA-N
MW250.26 g/mol
LogP1.00
Rot. Bonds4

About 4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine

4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine (PubChem CID 12771929) has the molecular formula C11H14N4O3 and a molecular weight of 250.26 g/mol. Its IUPAC name is 4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine.

Molecular Properties

Compound Name4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine
PubChem CID12771929
Molecular FormulaC11H14N4O3
Molecular Weight250.26 g/mol
Exact Mass250.11
IUPAC Name4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine
SMILESCOc1cc(OC)nc(-n2nc(C)cc2OC)n1
InChIInChI=1S/C11H14N4O3/c1-7-5-10(18-4)15(14-7)11-12-8(16-2)6-9(13-11)17-3/h5-6H,1-4H3
InChIKeyMTIDKMZISJDILC-UHFFFAOYSA-N
XLogP1.00
TPSA71.29 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.26
LogP ≤ 51.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine 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 4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine?
The IUPAC name of 4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine (CID 12771929) is 4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine.
What is the SMILES notation for 4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine?
The canonical SMILES for 4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine is COc1cc(OC)nc(-n2nc(C)cc2OC)n1.
What is the InChIKey of 4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine?
The InChIKey is MTIDKMZISJDILC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O3/c1-7-5-10(18-4)15(14-7)11-12-8(16-2)6-9(13-11)17-3/h5-6H,1-4H3.
What are the key properties of 4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine?
4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine has a molecular weight of 250.26 g/mol, XLogP of 1.00, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethoxy-2-(5-methoxy-3-methylpyrazol-1-yl)pyrimidine is sourced from PubChem (CID 12771929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).