5-fluoro-2-piperidin-4-yloxypyrimidine

C9H12FN3O — CID 23133629

IUPAC5-fluoro-2-piperidin-4-yloxypyrimidine
SMILESFc1cnc(OC2CCNCC2)nc1
InChIInChI=1S/C9H12FN3O/c10-7-5-12-9(13-6-7)14-8-1-3-11-4-2-8/h5-6,8,11H,1-4H2
InChIKeyNTSLMRPNSUCFKM-UHFFFAOYSA-N
MW197.21 g/mol
LogP0.75
Rot. Bonds2

About 5-fluoro-2-piperidin-4-yloxypyrimidine

5-fluoro-2-piperidin-4-yloxypyrimidine (PubChem CID 23133629) has the molecular formula C9H12FN3O and a molecular weight of 197.21 g/mol. Its IUPAC name is 5-fluoro-2-piperidin-4-yloxypyrimidine.

Molecular Properties

Compound Name5-fluoro-2-piperidin-4-yloxypyrimidine
PubChem CID23133629
Molecular FormulaC9H12FN3O
Molecular Weight197.21 g/mol
Exact Mass197.10
IUPAC Name5-fluoro-2-piperidin-4-yloxypyrimidine
SMILESFc1cnc(OC2CCNCC2)nc1
InChIInChI=1S/C9H12FN3O/c10-7-5-12-9(13-6-7)14-8-1-3-11-4-2-8/h5-6,8,11H,1-4H2
InChIKeyNTSLMRPNSUCFKM-UHFFFAOYSA-N
XLogP0.75
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.21
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-piperidin-4-yloxypyrimidine?
The IUPAC name of 5-fluoro-2-piperidin-4-yloxypyrimidine (CID 23133629) is 5-fluoro-2-piperidin-4-yloxypyrimidine.
What is the SMILES notation for 5-fluoro-2-piperidin-4-yloxypyrimidine?
The canonical SMILES for 5-fluoro-2-piperidin-4-yloxypyrimidine is Fc1cnc(OC2CCNCC2)nc1.
What is the InChIKey of 5-fluoro-2-piperidin-4-yloxypyrimidine?
The InChIKey is NTSLMRPNSUCFKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12FN3O/c10-7-5-12-9(13-6-7)14-8-1-3-11-4-2-8/h5-6,8,11H,1-4H2.
What are the key properties of 5-fluoro-2-piperidin-4-yloxypyrimidine?
5-fluoro-2-piperidin-4-yloxypyrimidine has a molecular weight of 197.21 g/mol, XLogP of 0.75, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-piperidin-4-yloxypyrimidine is sourced from PubChem (CID 23133629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).