2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one

C8H9NO — CID 14732815

IUPAC2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one
SMILESO=c1[nH]ccc2c1CCC2
InChIInChI=1S/C8H9NO/c10-8-7-3-1-2-6(7)4-5-9-8/h4-5H,1-3H2,(H,9,10)
InChIKeyYBMUMGHDTHYEKX-UHFFFAOYSA-N
MW135.17 g/mol
LogP0.86
Rot. Bonds

About 2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one

2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one (PubChem CID 14732815) has the molecular formula C8H9NO and a molecular weight of 135.17 g/mol. Its IUPAC name is 2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one.

Molecular Properties

Compound Name2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one
PubChem CID14732815
Molecular FormulaC8H9NO
Molecular Weight135.17 g/mol
Exact Mass135.07
IUPAC Name2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one
SMILESO=c1[nH]ccc2c1CCC2
InChIInChI=1S/C8H9NO/c10-8-7-3-1-2-6(7)4-5-9-8/h4-5H,1-3H2,(H,9,10)
InChIKeyYBMUMGHDTHYEKX-UHFFFAOYSA-N
XLogP0.86
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one?
The IUPAC name of 2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one (CID 14732815) is 2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one.
What is the SMILES notation for 2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one?
The canonical SMILES for 2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one is O=c1[nH]ccc2c1CCC2.
What is the InChIKey of 2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one?
The InChIKey is YBMUMGHDTHYEKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO/c10-8-7-3-1-2-6(7)4-5-9-8/h4-5H,1-3H2,(H,9,10).
What are the key properties of 2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one?
2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one has a molecular weight of 135.17 g/mol, XLogP of 0.86, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5,6,7-tetrahydrocyclopenta[c]pyridin-1-one is sourced from PubChem (CID 14732815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).