2-[(4-fluorophenyl)methoxy]pyrimidine

C11H9FN2O — CID 126953834

IUPAC2-[(4-fluorophenyl)methoxy]pyrimidine
SMILESFc1ccc(COc2ncccn2)cc1
InChIInChI=1S/C11H9FN2O/c12-10-4-2-9(3-5-10)8-15-11-13-6-1-7-14-11/h1-7H,8H2
InChIKeyZJDSBYSUCYXXHH-UHFFFAOYSA-N
MW204.20 g/mol
LogP2.19
Rot. Bonds3

About 2-[(4-fluorophenyl)methoxy]pyrimidine

2-[(4-fluorophenyl)methoxy]pyrimidine (PubChem CID 126953834) has the molecular formula C11H9FN2O and a molecular weight of 204.20 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methoxy]pyrimidine.

Molecular Properties

Compound Name2-[(4-fluorophenyl)methoxy]pyrimidine
PubChem CID126953834
Molecular FormulaC11H9FN2O
Molecular Weight204.20 g/mol
Exact Mass204.07
IUPAC Name2-[(4-fluorophenyl)methoxy]pyrimidine
SMILESFc1ccc(COc2ncccn2)cc1
InChIInChI=1S/C11H9FN2O/c12-10-4-2-9(3-5-10)8-15-11-13-6-1-7-14-11/h1-7H,8H2
InChIKeyZJDSBYSUCYXXHH-UHFFFAOYSA-N
XLogP2.19
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.20
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)methoxy]pyrimidine?
The IUPAC name of 2-[(4-fluorophenyl)methoxy]pyrimidine (CID 126953834) is 2-[(4-fluorophenyl)methoxy]pyrimidine.
What is the SMILES notation for 2-[(4-fluorophenyl)methoxy]pyrimidine?
The canonical SMILES for 2-[(4-fluorophenyl)methoxy]pyrimidine is Fc1ccc(COc2ncccn2)cc1.
What is the InChIKey of 2-[(4-fluorophenyl)methoxy]pyrimidine?
The InChIKey is ZJDSBYSUCYXXHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O/c12-10-4-2-9(3-5-10)8-15-11-13-6-1-7-14-11/h1-7H,8H2.
What are the key properties of 2-[(4-fluorophenyl)methoxy]pyrimidine?
2-[(4-fluorophenyl)methoxy]pyrimidine has a molecular weight of 204.20 g/mol, XLogP of 2.19, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)methoxy]pyrimidine is sourced from PubChem (CID 126953834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).