3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one

C10H12F2N2O — CID 170791459

IUPAC3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one
SMILESNc1cccn(C2CCC(F)(F)C2)c1=O
InChIInChI=1S/C10H12F2N2O/c11-10(12)4-3-7(6-10)14-5-1-2-8(13)9(14)15/h1-2,5,7H,3-4,6,13H2
InChIKeyQEZZXKISXJAIDG-UHFFFAOYSA-N
MW214.22 g/mol
LogP1.79
Rot. Bonds1

About 3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one

3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one (PubChem CID 170791459) has the molecular formula C10H12F2N2O and a molecular weight of 214.22 g/mol. Its IUPAC name is 3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one.

Molecular Properties

Compound Name3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one
PubChem CID170791459
Molecular FormulaC10H12F2N2O
Molecular Weight214.22 g/mol
Exact Mass214.09
IUPAC Name3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one
SMILESNc1cccn(C2CCC(F)(F)C2)c1=O
InChIInChI=1S/C10H12F2N2O/c11-10(12)4-3-7(6-10)14-5-1-2-8(13)9(14)15/h1-2,5,7H,3-4,6,13H2
InChIKeyQEZZXKISXJAIDG-UHFFFAOYSA-N
XLogP1.79
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one?
The IUPAC name of 3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one (CID 170791459) is 3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one.
What is the SMILES notation for 3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one?
The canonical SMILES for 3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one is Nc1cccn(C2CCC(F)(F)C2)c1=O.
What is the InChIKey of 3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one?
The InChIKey is QEZZXKISXJAIDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2N2O/c11-10(12)4-3-7(6-10)14-5-1-2-8(13)9(14)15/h1-2,5,7H,3-4,6,13H2.
What are the key properties of 3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one?
3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one has a molecular weight of 214.22 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(3,3-difluorocyclopentyl)pyridin-2-one is sourced from PubChem (CID 170791459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).