4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine

C9H11NO — CID 86726683

IUPAC4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine
SMILESCOc1ccnc2c1CCC2
InChIInChI=1S/C9H11NO/c1-11-9-5-6-10-8-4-2-3-7(8)9/h5-6H,2-4H2,1H3
InChIKeyVTFDRLJZDKJRPA-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.58
Rot. Bonds1

About 4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine

4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine (PubChem CID 86726683) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine.

Molecular Properties

Compound Name4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine
PubChem CID86726683
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine
SMILESCOc1ccnc2c1CCC2
InChIInChI=1S/C9H11NO/c1-11-9-5-6-10-8-4-2-3-7(8)9/h5-6H,2-4H2,1H3
InChIKeyVTFDRLJZDKJRPA-UHFFFAOYSA-N
XLogP1.58
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine?
The IUPAC name of 4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine (CID 86726683) is 4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine.
What is the SMILES notation for 4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine?
The canonical SMILES for 4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine is COc1ccnc2c1CCC2.
What is the InChIKey of 4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine?
The InChIKey is VTFDRLJZDKJRPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-11-9-5-6-10-8-4-2-3-7(8)9/h5-6H,2-4H2,1H3.
What are the key properties of 4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine?
4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine has a molecular weight of 149.19 g/mol, XLogP of 1.58, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine is sourced from PubChem (CID 86726683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).