5-fluoro-2-pyrrolidin-3-yloxypyrimidine

C8H10FN3O — CID 71643588

IUPAC5-fluoro-2-pyrrolidin-3-yloxypyrimidine
SMILESFc1cnc(OC2CCNC2)nc1
InChIInChI=1S/C8H10FN3O/c9-6-3-11-8(12-4-6)13-7-1-2-10-5-7/h3-4,7,10H,1-2,5H2
InChIKeyRFQJHXYKEGROCP-UHFFFAOYSA-N
MW183.19 g/mol
LogP0.36
Rot. Bonds2

About 5-fluoro-2-pyrrolidin-3-yloxypyrimidine

5-fluoro-2-pyrrolidin-3-yloxypyrimidine (PubChem CID 71643588) has the molecular formula C8H10FN3O and a molecular weight of 183.19 g/mol. Its IUPAC name is 5-fluoro-2-pyrrolidin-3-yloxypyrimidine.

Molecular Properties

Compound Name5-fluoro-2-pyrrolidin-3-yloxypyrimidine
PubChem CID71643588
Molecular FormulaC8H10FN3O
Molecular Weight183.19 g/mol
Exact Mass183.08
IUPAC Name5-fluoro-2-pyrrolidin-3-yloxypyrimidine
SMILESFc1cnc(OC2CCNC2)nc1
InChIInChI=1S/C8H10FN3O/c9-6-3-11-8(12-4-6)13-7-1-2-10-5-7/h3-4,7,10H,1-2,5H2
InChIKeyRFQJHXYKEGROCP-UHFFFAOYSA-N
XLogP0.36
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.19
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-pyrrolidin-3-yloxypyrimidine?
The IUPAC name of 5-fluoro-2-pyrrolidin-3-yloxypyrimidine (CID 71643588) is 5-fluoro-2-pyrrolidin-3-yloxypyrimidine.
What is the SMILES notation for 5-fluoro-2-pyrrolidin-3-yloxypyrimidine?
The canonical SMILES for 5-fluoro-2-pyrrolidin-3-yloxypyrimidine is Fc1cnc(OC2CCNC2)nc1.
What is the InChIKey of 5-fluoro-2-pyrrolidin-3-yloxypyrimidine?
The InChIKey is RFQJHXYKEGROCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FN3O/c9-6-3-11-8(12-4-6)13-7-1-2-10-5-7/h3-4,7,10H,1-2,5H2.
What are the key properties of 5-fluoro-2-pyrrolidin-3-yloxypyrimidine?
5-fluoro-2-pyrrolidin-3-yloxypyrimidine has a molecular weight of 183.19 g/mol, XLogP of 0.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-pyrrolidin-3-yloxypyrimidine is sourced from PubChem (CID 71643588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).