1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one

C8H9NO2 — CID 122623826

IUPAC1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one
SMILESO=c1ccc2c(n1O)CCC2
InChIInChI=1S/C8H9NO2/c10-8-5-4-6-2-1-3-7(6)9(8)11/h4-5,11H,1-3H2
InChIKeyAQYKPTIGEXYVTN-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.57
Rot. Bonds

About 1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one

1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one (PubChem CID 122623826) has the molecular formula C8H9NO2 and a molecular weight of 151.16 g/mol. Its IUPAC name is 1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one.

Molecular Properties

Compound Name1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one
PubChem CID122623826
Molecular FormulaC8H9NO2
Molecular Weight151.16 g/mol
Exact Mass151.06
IUPAC Name1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one
SMILESO=c1ccc2c(n1O)CCC2
InChIInChI=1S/C8H9NO2/c10-8-5-4-6-2-1-3-7(6)9(8)11/h4-5,11H,1-3H2
InChIKeyAQYKPTIGEXYVTN-UHFFFAOYSA-N
XLogP0.57
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one?
The IUPAC name of 1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one (CID 122623826) is 1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one.
What is the SMILES notation for 1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one?
The canonical SMILES for 1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one is O=c1ccc2c(n1O)CCC2.
What is the InChIKey of 1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one?
The InChIKey is AQYKPTIGEXYVTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2/c10-8-5-4-6-2-1-3-7(6)9(8)11/h4-5,11H,1-3H2.
What are the key properties of 1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one?
1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one has a molecular weight of 151.16 g/mol, XLogP of 0.57, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one is sourced from PubChem (CID 122623826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).