6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid

C9H9NO2 — CID 58852290

IUPAC6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid
SMILESO=C(O)C1Cc2ccncc2C1
InChIInChI=1S/C9H9NO2/c11-9(12)7-3-6-1-2-10-5-8(6)4-7/h1-2,5,7H,3-4H2,(H,11,12)
InChIKeyYTQCZSCAOKEFKV-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.88
Rot. Bonds1

About 6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid

6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid (PubChem CID 58852290) has the molecular formula C9H9NO2 and a molecular weight of 163.18 g/mol. Its IUPAC name is 6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid
PubChem CID58852290
Molecular FormulaC9H9NO2
Molecular Weight163.18 g/mol
Exact Mass163.06
IUPAC Name6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid
SMILESO=C(O)C1Cc2ccncc2C1
InChIInChI=1S/C9H9NO2/c11-9(12)7-3-6-1-2-10-5-8(6)4-7/h1-2,5,7H,3-4H2,(H,11,12)
InChIKeyYTQCZSCAOKEFKV-UHFFFAOYSA-N
XLogP0.88
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid?
The IUPAC name of 6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid (CID 58852290) is 6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid.
What is the SMILES notation for 6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid?
The canonical SMILES for 6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid is O=C(O)C1Cc2ccncc2C1.
What is the InChIKey of 6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid?
The InChIKey is YTQCZSCAOKEFKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO2/c11-9(12)7-3-6-1-2-10-5-8(6)4-7/h1-2,5,7H,3-4H2,(H,11,12).
What are the key properties of 6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid?
6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid has a molecular weight of 163.18 g/mol, XLogP of 0.88, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid is sourced from PubChem (CID 58852290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).