(5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone

C10H10FNO2 — CID 65331131

IUPAC(5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone
SMILESO=C(c1cncc(F)c1)C1CCCO1
InChIInChI=1S/C10H10FNO2/c11-8-4-7(5-12-6-8)10(13)9-2-1-3-14-9/h4-6,9H,1-3H2
InChIKeyKQPZOETZBORCSA-UHFFFAOYSA-N
MW195.19 g/mol
LogP1.58
Rot. Bonds2

About (5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone

(5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone (PubChem CID 65331131) has the molecular formula C10H10FNO2 and a molecular weight of 195.19 g/mol. Its IUPAC name is (5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone.

Molecular Properties

Compound Name(5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone
PubChem CID65331131
Molecular FormulaC10H10FNO2
Molecular Weight195.19 g/mol
Exact Mass195.07
IUPAC Name(5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone
SMILESO=C(c1cncc(F)c1)C1CCCO1
InChIInChI=1S/C10H10FNO2/c11-8-4-7(5-12-6-8)10(13)9-2-1-3-14-9/h4-6,9H,1-3H2
InChIKeyKQPZOETZBORCSA-UHFFFAOYSA-N
XLogP1.58
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.19
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone?
The IUPAC name of (5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone (CID 65331131) is (5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone.
What is the SMILES notation for (5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone?
The canonical SMILES for (5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone is O=C(c1cncc(F)c1)C1CCCO1.
What is the InChIKey of (5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone?
The InChIKey is KQPZOETZBORCSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO2/c11-8-4-7(5-12-6-8)10(13)9-2-1-3-14-9/h4-6,9H,1-3H2.
What are the key properties of (5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone?
(5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone has a molecular weight of 195.19 g/mol, XLogP of 1.58, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-3-pyridinyl)-(oxolan-2-yl)methanone is sourced from PubChem (CID 65331131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).