4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one

C10H13FN2O — CID 71433112

IUPAC4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one
SMILESO=c1cc(C2CCNCC2F)cc[nH]1
InChIInChI=1S/C10H13FN2O/c11-9-6-12-3-2-8(9)7-1-4-13-10(14)5-7/h1,4-5,8-9,12H,2-3,6H2,(H,13,14)
InChIKeyFJFGXYZXZGYEEM-UHFFFAOYSA-N
MW196.22 g/mol
LogP0.79
Rot. Bonds1

About 4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one

4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one (PubChem CID 71433112) has the molecular formula C10H13FN2O and a molecular weight of 196.22 g/mol. Its IUPAC name is 4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one
PubChem CID71433112
Molecular FormulaC10H13FN2O
Molecular Weight196.22 g/mol
Exact Mass196.10
IUPAC Name4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one
SMILESO=c1cc(C2CCNCC2F)cc[nH]1
InChIInChI=1S/C10H13FN2O/c11-9-6-12-3-2-8(9)7-1-4-13-10(14)5-7/h1,4-5,8-9,12H,2-3,6H2,(H,13,14)
InChIKeyFJFGXYZXZGYEEM-UHFFFAOYSA-N
XLogP0.79
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.22
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one?
The IUPAC name of 4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one (CID 71433112) is 4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one.
What is the SMILES notation for 4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one?
The canonical SMILES for 4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one is O=c1cc(C2CCNCC2F)cc[nH]1.
What is the InChIKey of 4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one?
The InChIKey is FJFGXYZXZGYEEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O/c11-9-6-12-3-2-8(9)7-1-4-13-10(14)5-7/h1,4-5,8-9,12H,2-3,6H2,(H,13,14).
What are the key properties of 4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one?
4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one has a molecular weight of 196.22 g/mol, XLogP of 0.79, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluoropiperidin-4-yl)-1H-pyridin-2-one is sourced from PubChem (CID 71433112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).