4H-cyclopenta[b]pyridine

C8H7N — CID 56972377

IUPAC4H-cyclopenta[b]pyridine
SMILESC1=CC2=NC=CCC2=C1
InChIInChI=1S/C8H7N/c1-3-7-4-2-6-9-8(7)5-1/h1-3,5-6H,4H2
InChIKeyHBSXSXOWQNJJER-UHFFFAOYSA-N
MW117.15 g/mol
LogP1.84
Rot. Bonds

About 4H-cyclopenta[b]pyridine

4H-cyclopenta[b]pyridine (PubChem CID 56972377) has the molecular formula C8H7N and a molecular weight of 117.15 g/mol. Its IUPAC name is 4H-cyclopenta[b]pyridine.

Molecular Properties

Compound Name4H-cyclopenta[b]pyridine
PubChem CID56972377
Molecular FormulaC8H7N
Molecular Weight117.15 g/mol
Exact Mass117.06
IUPAC Name4H-cyclopenta[b]pyridine
SMILESC1=CC2=NC=CCC2=C1
InChIInChI=1S/C8H7N/c1-3-7-4-2-6-9-8(7)5-1/h1-3,5-6H,4H2
InChIKeyHBSXSXOWQNJJER-UHFFFAOYSA-N
XLogP1.84
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.15
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4H-cyclopenta[b]pyridine?
The IUPAC name of 4H-cyclopenta[b]pyridine (CID 56972377) is 4H-cyclopenta[b]pyridine.
What is the SMILES notation for 4H-cyclopenta[b]pyridine?
The canonical SMILES for 4H-cyclopenta[b]pyridine is C1=CC2=NC=CCC2=C1.
What is the InChIKey of 4H-cyclopenta[b]pyridine?
The InChIKey is HBSXSXOWQNJJER-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N/c1-3-7-4-2-6-9-8(7)5-1/h1-3,5-6H,4H2.
What are the key properties of 4H-cyclopenta[b]pyridine?
4H-cyclopenta[b]pyridine has a molecular weight of 117.15 g/mol, XLogP of 1.84, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4H-cyclopenta[b]pyridine is sourced from PubChem (CID 56972377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).