6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxylic acid

C9H9NO2 — CID 83669226

IUPAC6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxylic acid
SMILESO=C(O)c1nccc2c1CCC2
InChIInChI=1S/C9H9NO2/c11-9(12)8-7-3-1-2-6(7)4-5-10-8/h4-5H,1-3H2,(H,11,12)
InChIKeyIRBZXFBNTZTOKD-UHFFFAOYSA-N
MW163.18 g/mol
LogP1.27
Rot. Bonds1

About 6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxylic acid

6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxylic acid (PubChem CID 83669226) 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-1-carboxylic acid.

Molecular Properties

Compound Name6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxylic acid
PubChem CID83669226
Molecular FormulaC9H9NO2
Molecular Weight163.18 g/mol
Exact Mass163.06
IUPAC Name6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxylic acid
SMILESO=C(O)c1nccc2c1CCC2
InChIInChI=1S/C9H9NO2/c11-9(12)8-7-3-1-2-6(7)4-5-10-8/h4-5H,1-3H2,(H,11,12)
InChIKeyIRBZXFBNTZTOKD-UHFFFAOYSA-N
XLogP1.27
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 ≤ 51.27
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-1-carboxylic acid?
The IUPAC name of 6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxylic acid (CID 83669226) is 6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxylic acid.
What is the SMILES notation for 6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxylic acid?
The canonical SMILES for 6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxylic acid is O=C(O)c1nccc2c1CCC2.
What is the InChIKey of 6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxylic acid?
The InChIKey is IRBZXFBNTZTOKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO2/c11-9(12)8-7-3-1-2-6(7)4-5-10-8/h4-5H,1-3H2,(H,11,12).
What are the key properties of 6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxylic acid?
6,7-dihydro-5H-cyclopenta[c]pyridine-1-carboxylic acid has a molecular weight of 163.18 g/mol, XLogP of 1.27, 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-1-carboxylic acid is sourced from PubChem (CID 83669226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).