4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine

C10H11FN2 — CID 90464587

IUPAC4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine
SMILESC=Cc1nc(C)c(F)c(C2CC2)n1
InChIInChI=1S/C10H11FN2/c1-3-8-12-6(2)9(11)10(13-8)7-4-5-7/h3,7H,1,4-5H2,2H3
InChIKeyVZVHRFUUXZCGCC-UHFFFAOYSA-N
MW178.21 g/mol
LogP2.44
Rot. Bonds2

About 4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine

4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine (PubChem CID 90464587) has the molecular formula C10H11FN2 and a molecular weight of 178.21 g/mol. Its IUPAC name is 4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine.

Molecular Properties

Compound Name4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine
PubChem CID90464587
Molecular FormulaC10H11FN2
Molecular Weight178.21 g/mol
Exact Mass178.09
IUPAC Name4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine
SMILESC=Cc1nc(C)c(F)c(C2CC2)n1
InChIInChI=1S/C10H11FN2/c1-3-8-12-6(2)9(11)10(13-8)7-4-5-7/h3,7H,1,4-5H2,2H3
InChIKeyVZVHRFUUXZCGCC-UHFFFAOYSA-N
XLogP2.44
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.21
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine 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-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine?
The IUPAC name of 4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine (CID 90464587) is 4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine.
What is the SMILES notation for 4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine?
The canonical SMILES for 4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine is C=Cc1nc(C)c(F)c(C2CC2)n1.
What is the InChIKey of 4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine?
The InChIKey is VZVHRFUUXZCGCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2/c1-3-8-12-6(2)9(11)10(13-8)7-4-5-7/h3,7H,1,4-5H2,2H3.
What are the key properties of 4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine?
4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine has a molecular weight of 178.21 g/mol, XLogP of 2.44, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-2-ethenyl-5-fluoro-6-methylpyrimidine is sourced from PubChem (CID 90464587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).