3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one

C16H17FN2O — CID 82466930

IUPAC3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one
SMILESNc1ccc(-c2ccc(F)cc2)n(C2CCCC2)c1=O
InChIInChI=1S/C16H17FN2O/c17-12-7-5-11(6-8-12)15-10-9-14(18)16(20)19(15)13-3-1-2-4-13/h5-10,13H,1-4,18H2
InChIKeyDPJCSLAOJXTWKD-UHFFFAOYSA-N
MW272.32 g/mol
LogP3.35
Rot. Bonds2

About 3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one

3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one (PubChem CID 82466930) has the molecular formula C16H17FN2O and a molecular weight of 272.32 g/mol. Its IUPAC name is 3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one.

Molecular Properties

Compound Name3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one
PubChem CID82466930
Molecular FormulaC16H17FN2O
Molecular Weight272.32 g/mol
Exact Mass272.13
IUPAC Name3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one
SMILESNc1ccc(-c2ccc(F)cc2)n(C2CCCC2)c1=O
InChIInChI=1S/C16H17FN2O/c17-12-7-5-11(6-8-12)15-10-9-14(18)16(20)19(15)13-3-1-2-4-13/h5-10,13H,1-4,18H2
InChIKeyDPJCSLAOJXTWKD-UHFFFAOYSA-N
XLogP3.35
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one?
The IUPAC name of 3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one (CID 82466930) is 3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one.
What is the SMILES notation for 3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one?
The canonical SMILES for 3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one is Nc1ccc(-c2ccc(F)cc2)n(C2CCCC2)c1=O.
What is the InChIKey of 3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one?
The InChIKey is DPJCSLAOJXTWKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O/c17-12-7-5-11(6-8-12)15-10-9-14(18)16(20)19(15)13-3-1-2-4-13/h5-10,13H,1-4,18H2.
What are the key properties of 3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one?
3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one has a molecular weight of 272.32 g/mol, XLogP of 3.35, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-cyclopentyl-6-(4-fluorophenyl)pyridin-2-one is sourced from PubChem (CID 82466930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).