5-fluoro-2,4-di(piperidin-1-yl)pyrimidine

C14H21FN4 — CID 677821

IUPAC5-fluoro-2,4-di(piperidin-1-yl)pyrimidine
SMILESFc1cnc(N2CCCCC2)nc1N1CCCCC1
InChIInChI=1S/C14H21FN4/c15-12-11-16-14(19-9-5-2-6-10-19)17-13(12)18-7-3-1-4-8-18/h11H,1-10H2
InChIKeyVYPASFBYUHIMCW-UHFFFAOYSA-N
MW264.35 g/mol
LogP2.60
Rot. Bonds2

About 5-fluoro-2,4-di(piperidin-1-yl)pyrimidine

5-fluoro-2,4-di(piperidin-1-yl)pyrimidine (PubChem CID 677821) has the molecular formula C14H21FN4 and a molecular weight of 264.35 g/mol. Its IUPAC name is 5-fluoro-2,4-di(piperidin-1-yl)pyrimidine.

Molecular Properties

Compound Name5-fluoro-2,4-di(piperidin-1-yl)pyrimidine
PubChem CID677821
Molecular FormulaC14H21FN4
Molecular Weight264.35 g/mol
Exact Mass264.18
IUPAC Name5-fluoro-2,4-di(piperidin-1-yl)pyrimidine
SMILESFc1cnc(N2CCCCC2)nc1N1CCCCC1
InChIInChI=1S/C14H21FN4/c15-12-11-16-14(19-9-5-2-6-10-19)17-13(12)18-7-3-1-4-8-18/h11H,1-10H2
InChIKeyVYPASFBYUHIMCW-UHFFFAOYSA-N
XLogP2.60
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2,4-di(piperidin-1-yl)pyrimidine?
The IUPAC name of 5-fluoro-2,4-di(piperidin-1-yl)pyrimidine (CID 677821) is 5-fluoro-2,4-di(piperidin-1-yl)pyrimidine.
What is the SMILES notation for 5-fluoro-2,4-di(piperidin-1-yl)pyrimidine?
The canonical SMILES for 5-fluoro-2,4-di(piperidin-1-yl)pyrimidine is Fc1cnc(N2CCCCC2)nc1N1CCCCC1.
What is the InChIKey of 5-fluoro-2,4-di(piperidin-1-yl)pyrimidine?
The InChIKey is VYPASFBYUHIMCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN4/c15-12-11-16-14(19-9-5-2-6-10-19)17-13(12)18-7-3-1-4-8-18/h11H,1-10H2.
What are the key properties of 5-fluoro-2,4-di(piperidin-1-yl)pyrimidine?
5-fluoro-2,4-di(piperidin-1-yl)pyrimidine has a molecular weight of 264.35 g/mol, XLogP of 2.60, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2,4-di(piperidin-1-yl)pyrimidine is sourced from PubChem (CID 677821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).