4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine

C11H10FN3O — CID 126767017

IUPAC4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine
SMILESCCc1ncnc(Oc2cccnc2)c1F
InChIInChI=1S/C11H10FN3O/c1-2-9-10(12)11(15-7-14-9)16-8-4-3-5-13-6-8/h3-7H,2H2,1H3
InChIKeyYJMVXVQLQVRTMN-UHFFFAOYSA-N
MW219.22 g/mol
LogP2.37
Rot. Bonds3

About 4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine

4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine (PubChem CID 126767017) has the molecular formula C11H10FN3O and a molecular weight of 219.22 g/mol. Its IUPAC name is 4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine.

Molecular Properties

Compound Name4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine
PubChem CID126767017
Molecular FormulaC11H10FN3O
Molecular Weight219.22 g/mol
Exact Mass219.08
IUPAC Name4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine
SMILESCCc1ncnc(Oc2cccnc2)c1F
InChIInChI=1S/C11H10FN3O/c1-2-9-10(12)11(15-7-14-9)16-8-4-3-5-13-6-8/h3-7H,2H2,1H3
InChIKeyYJMVXVQLQVRTMN-UHFFFAOYSA-N
XLogP2.37
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.22
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine?
The IUPAC name of 4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine (CID 126767017) is 4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine.
What is the SMILES notation for 4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine?
The canonical SMILES for 4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine is CCc1ncnc(Oc2cccnc2)c1F.
What is the InChIKey of 4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine?
The InChIKey is YJMVXVQLQVRTMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3O/c1-2-9-10(12)11(15-7-14-9)16-8-4-3-5-13-6-8/h3-7H,2H2,1H3.
What are the key properties of 4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine?
4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine has a molecular weight of 219.22 g/mol, XLogP of 2.37, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-fluoro-6-pyridin-3-yloxypyrimidine is sourced from PubChem (CID 126767017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).