3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one

C19H19FN4O2 — CID 71841318

IUPAC3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one
SMILESO=C(Cn1c(=O)n(-c2ccc(F)cc2)c2ncccc21)N1CCCCC1
InChIInChI=1S/C19H19FN4O2/c20-14-6-8-15(9-7-14)24-18-16(5-4-10-21-18)23(19(24)26)13-17(25)22-11-2-1-3-12-22/h4-10H,1-3,11-13H2
InChIKeyXFHMEZFGFGSMKO-UHFFFAOYSA-N
MW354.38 g/mol
LogP2.34
Rot. Bonds3

About 3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one

3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one (PubChem CID 71841318) has the molecular formula C19H19FN4O2 and a molecular weight of 354.38 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one
PubChem CID71841318
Molecular FormulaC19H19FN4O2
Molecular Weight354.38 g/mol
Exact Mass354.15
IUPAC Name3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one
SMILESO=C(Cn1c(=O)n(-c2ccc(F)cc2)c2ncccc21)N1CCCCC1
InChIInChI=1S/C19H19FN4O2/c20-14-6-8-15(9-7-14)24-18-16(5-4-10-21-18)23(19(24)26)13-17(25)22-11-2-1-3-12-22/h4-10H,1-3,11-13H2
InChIKeyXFHMEZFGFGSMKO-UHFFFAOYSA-N
XLogP2.34
TPSA60.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.38
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one?
The IUPAC name of 3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one (CID 71841318) is 3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one is O=C(Cn1c(=O)n(-c2ccc(F)cc2)c2ncccc21)N1CCCCC1.
What is the InChIKey of 3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one?
The InChIKey is XFHMEZFGFGSMKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4O2/c20-14-6-8-15(9-7-14)24-18-16(5-4-10-21-18)23(19(24)26)13-17(25)22-11-2-1-3-12-22/h4-10H,1-3,11-13H2.
What are the key properties of 3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one?
3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one has a molecular weight of 354.38 g/mol, XLogP of 2.34, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-1-(2-oxo-2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 71841318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).