5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine

C11H16FN3O — CID 71643597

IUPAC5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine
SMILESFc1cnc(OCCC2CCCCN2)nc1
InChIInChI=1S/C11H16FN3O/c12-9-7-14-11(15-8-9)16-6-4-10-3-1-2-5-13-10/h7-8,10,13H,1-6H2
InChIKeyUZKJXJVGQOKBLR-UHFFFAOYSA-N
MW225.27 g/mol
LogP1.53
Rot. Bonds4

About 5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine

5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine (PubChem CID 71643597) has the molecular formula C11H16FN3O and a molecular weight of 225.27 g/mol. Its IUPAC name is 5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine.

Molecular Properties

Compound Name5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine
PubChem CID71643597
Molecular FormulaC11H16FN3O
Molecular Weight225.27 g/mol
Exact Mass225.13
IUPAC Name5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine
SMILESFc1cnc(OCCC2CCCCN2)nc1
InChIInChI=1S/C11H16FN3O/c12-9-7-14-11(15-8-9)16-6-4-10-3-1-2-5-13-10/h7-8,10,13H,1-6H2
InChIKeyUZKJXJVGQOKBLR-UHFFFAOYSA-N
XLogP1.53
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine?
The IUPAC name of 5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine (CID 71643597) is 5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine.
What is the SMILES notation for 5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine?
The canonical SMILES for 5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine is Fc1cnc(OCCC2CCCCN2)nc1.
What is the InChIKey of 5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine?
The InChIKey is UZKJXJVGQOKBLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FN3O/c12-9-7-14-11(15-8-9)16-6-4-10-3-1-2-5-13-10/h7-8,10,13H,1-6H2.
What are the key properties of 5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine?
5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine has a molecular weight of 225.27 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-(2-piperidin-2-ylethoxy)pyrimidine is sourced from PubChem (CID 71643597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).