5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine

C10H9FN4 — CID 123211234

IUPAC5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine
SMILESCc1cc(-c2nc(C)ncc2F)cnn1
InChIInChI=1S/C10H9FN4/c1-6-3-8(4-13-15-6)10-9(11)5-12-7(2)14-10/h3-5H,1-2H3
InChIKeyLOTJILXIEGEGRI-UHFFFAOYSA-N
MW204.21 g/mol
LogP1.69
Rot. Bonds1

About 5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine

5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine (PubChem CID 123211234) has the molecular formula C10H9FN4 and a molecular weight of 204.21 g/mol. Its IUPAC name is 5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine.

Molecular Properties

Compound Name5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine
PubChem CID123211234
Molecular FormulaC10H9FN4
Molecular Weight204.21 g/mol
Exact Mass204.08
IUPAC Name5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine
SMILESCc1cc(-c2nc(C)ncc2F)cnn1
InChIInChI=1S/C10H9FN4/c1-6-3-8(4-13-15-6)10-9(11)5-12-7(2)14-10/h3-5H,1-2H3
InChIKeyLOTJILXIEGEGRI-UHFFFAOYSA-N
XLogP1.69
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.21
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine?
The IUPAC name of 5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine (CID 123211234) is 5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine.
What is the SMILES notation for 5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine?
The canonical SMILES for 5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine is Cc1cc(-c2nc(C)ncc2F)cnn1.
What is the InChIKey of 5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine?
The InChIKey is LOTJILXIEGEGRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN4/c1-6-3-8(4-13-15-6)10-9(11)5-12-7(2)14-10/h3-5H,1-2H3.
What are the key properties of 5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine?
5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine has a molecular weight of 204.21 g/mol, XLogP of 1.69, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methyl-4-(6-methylpyridazin-4-yl)pyrimidine is sourced from PubChem (CID 123211234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).