4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine

C9H10N4O — CID 10702834

IUPAC4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine
SMILESCOc1cc(C)nc(-n2cccn2)n1
InChIInChI=1S/C9H10N4O/c1-7-6-8(14-2)12-9(11-7)13-5-3-4-10-13/h3-6H,1-2H3
InChIKeyJMOIYFQXFXBKRH-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.98
Rot. Bonds2

About 4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine

4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine (PubChem CID 10702834) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine.

Molecular Properties

Compound Name4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine
PubChem CID10702834
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine
SMILESCOc1cc(C)nc(-n2cccn2)n1
InChIInChI=1S/C9H10N4O/c1-7-6-8(14-2)12-9(11-7)13-5-3-4-10-13/h3-6H,1-2H3
InChIKeyJMOIYFQXFXBKRH-UHFFFAOYSA-N
XLogP0.98
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine?
The IUPAC name of 4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine (CID 10702834) is 4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine.
What is the SMILES notation for 4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine?
The canonical SMILES for 4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine is COc1cc(C)nc(-n2cccn2)n1.
What is the InChIKey of 4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine?
The InChIKey is JMOIYFQXFXBKRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-7-6-8(14-2)12-9(11-7)13-5-3-4-10-13/h3-6H,1-2H3.
What are the key properties of 4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine?
4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine has a molecular weight of 190.21 g/mol, XLogP of 0.98, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-methyl-2-pyrazol-1-ylpyrimidine is sourced from PubChem (CID 10702834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).