6-(2-fluoropropan-2-yl)-1H-pyridin-2-one

C8H10FNO — CID 59928343

IUPAC6-(2-fluoropropan-2-yl)-1H-pyridin-2-one
SMILESCC(C)(F)c1cccc(=O)[nH]1
InChIInChI=1S/C8H10FNO/c1-8(2,9)6-4-3-5-7(11)10-6/h3-5H,1-2H3,(H,10,11)
InChIKeyLMQPIYUEWINPBE-UHFFFAOYSA-N
MW155.17 g/mol
LogP1.58
Rot. Bonds1

About 6-(2-fluoropropan-2-yl)-1H-pyridin-2-one

6-(2-fluoropropan-2-yl)-1H-pyridin-2-one (PubChem CID 59928343) has the molecular formula C8H10FNO and a molecular weight of 155.17 g/mol. Its IUPAC name is 6-(2-fluoropropan-2-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(2-fluoropropan-2-yl)-1H-pyridin-2-one
PubChem CID59928343
Molecular FormulaC8H10FNO
Molecular Weight155.17 g/mol
Exact Mass155.07
IUPAC Name6-(2-fluoropropan-2-yl)-1H-pyridin-2-one
SMILESCC(C)(F)c1cccc(=O)[nH]1
InChIInChI=1S/C8H10FNO/c1-8(2,9)6-4-3-5-7(11)10-6/h3-5H,1-2H3,(H,10,11)
InChIKeyLMQPIYUEWINPBE-UHFFFAOYSA-N
XLogP1.58
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.17
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoropropan-2-yl)-1H-pyridin-2-one?
The IUPAC name of 6-(2-fluoropropan-2-yl)-1H-pyridin-2-one (CID 59928343) is 6-(2-fluoropropan-2-yl)-1H-pyridin-2-one.
What is the SMILES notation for 6-(2-fluoropropan-2-yl)-1H-pyridin-2-one?
The canonical SMILES for 6-(2-fluoropropan-2-yl)-1H-pyridin-2-one is CC(C)(F)c1cccc(=O)[nH]1.
What is the InChIKey of 6-(2-fluoropropan-2-yl)-1H-pyridin-2-one?
The InChIKey is LMQPIYUEWINPBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO/c1-8(2,9)6-4-3-5-7(11)10-6/h3-5H,1-2H3,(H,10,11).
What are the key properties of 6-(2-fluoropropan-2-yl)-1H-pyridin-2-one?
6-(2-fluoropropan-2-yl)-1H-pyridin-2-one has a molecular weight of 155.17 g/mol, XLogP of 1.58, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoropropan-2-yl)-1H-pyridin-2-one is sourced from PubChem (CID 59928343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).