2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one

C15H15FN2O2 — CID 79439270

IUPAC2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one
SMILESO=c1[nH]c(C2CCCC2)nc(O)c1-c1ccccc1F
InChIInChI=1S/C15H15FN2O2/c16-11-8-4-3-7-10(11)12-14(19)17-13(18-15(12)20)9-5-1-2-6-9/h3-4,7-9H,1-2,5-6H2,(H2,17,18,19,20)
InChIKeyZHCRAOWNOGTPOH-UHFFFAOYSA-N
MW274.29 g/mol
LogP2.94
Rot. Bonds2

About 2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one

2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one (PubChem CID 79439270) has the molecular formula C15H15FN2O2 and a molecular weight of 274.29 g/mol. Its IUPAC name is 2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one
PubChem CID79439270
Molecular FormulaC15H15FN2O2
Molecular Weight274.29 g/mol
Exact Mass274.11
IUPAC Name2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one
SMILESO=c1[nH]c(C2CCCC2)nc(O)c1-c1ccccc1F
InChIInChI=1S/C15H15FN2O2/c16-11-8-4-3-7-10(11)12-14(19)17-13(18-15(12)20)9-5-1-2-6-9/h3-4,7-9H,1-2,5-6H2,(H2,17,18,19,20)
InChIKeyZHCRAOWNOGTPOH-UHFFFAOYSA-N
XLogP2.94
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.29
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one?
The IUPAC name of 2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one (CID 79439270) is 2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one.
What is the SMILES notation for 2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one?
The canonical SMILES for 2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one is O=c1[nH]c(C2CCCC2)nc(O)c1-c1ccccc1F.
What is the InChIKey of 2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one?
The InChIKey is ZHCRAOWNOGTPOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2/c16-11-8-4-3-7-10(11)12-14(19)17-13(18-15(12)20)9-5-1-2-6-9/h3-4,7-9H,1-2,5-6H2,(H2,17,18,19,20).
What are the key properties of 2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one?
2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one has a molecular weight of 274.29 g/mol, XLogP of 2.94, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one is sourced from PubChem (CID 79439270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).