4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine

C13H19FN4O — CID 3631524

IUPAC4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine
SMILESFc1cnc(N2CCCCC2)nc1N1CCOCC1
InChIInChI=1S/C13H19FN4O/c14-11-10-15-13(18-4-2-1-3-5-18)16-12(11)17-6-8-19-9-7-17/h10H,1-9H2
InChIKeyMKPXGGSMHNSXKC-UHFFFAOYSA-N
MW266.32 g/mol
LogP1.44
Rot. Bonds2

About 4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine

4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine (PubChem CID 3631524) has the molecular formula C13H19FN4O and a molecular weight of 266.32 g/mol. Its IUPAC name is 4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine
PubChem CID3631524
Molecular FormulaC13H19FN4O
Molecular Weight266.32 g/mol
Exact Mass266.15
IUPAC Name4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine
SMILESFc1cnc(N2CCCCC2)nc1N1CCOCC1
InChIInChI=1S/C13H19FN4O/c14-11-10-15-13(18-4-2-1-3-5-18)16-12(11)17-6-8-19-9-7-17/h10H,1-9H2
InChIKeyMKPXGGSMHNSXKC-UHFFFAOYSA-N
XLogP1.44
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine?
The IUPAC name of 4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine (CID 3631524) is 4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine.
What is the SMILES notation for 4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine?
The canonical SMILES for 4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine is Fc1cnc(N2CCCCC2)nc1N1CCOCC1.
What is the InChIKey of 4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine?
The InChIKey is MKPXGGSMHNSXKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN4O/c14-11-10-15-13(18-4-2-1-3-5-18)16-12(11)17-6-8-19-9-7-17/h10H,1-9H2.
What are the key properties of 4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine?
4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine has a molecular weight of 266.32 g/mol, XLogP of 1.44, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-fluoro-2-piperidin-1-ylpyrimidin-4-yl)morpholine is sourced from PubChem (CID 3631524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).