4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine

Name: 4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₆H₁₈N₂ — CID 146613279

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine

SMILESCC(C)c1c(-c2ccncc2)cnc2c1CCC2

InChIInChI=1S/C16H18N2/c1-11(2)16-13-4-3-5-15(13)18-10-14(16)12-6-8-17-9-7-12/h6-11H,3-5H2,1-2H3

InChIKeyVOPCUFVAEPUCPD-UHFFFAOYSA-N

MW238.33 g/mol

LogP3.76

Rot. Bonds2

About 4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine

4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine (PubChem CID 146613279) has the molecular formula C₁₆H₁₈N₂ and a molecular weight of 238.33 g/mol. Its IUPAC name is 4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine.

Molecular Properties

Compound Name	4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine
PubChem CID	146613279
Molecular Formula	C₁₆H₁₈N₂
Molecular Weight	238.33 g/mol
Exact Mass	238.15
IUPAC Name	4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine
SMILES	CC(C)c1c(-c2ccncc2)cnc2c1CCC2
InChI	InChI=1S/C16H18N2/c1-11(2)16-13-4-3-5-15(13)18-10-14(16)12-6-8-17-9-7-12/h6-11H,3-5H2,1-2H3
InChIKey	VOPCUFVAEPUCPD-UHFFFAOYSA-N
XLogP	3.76
TPSA	25.78 Å²
H-Bond Donors
H-Bond Acceptors	2
Rotatable Bonds	2
Heavy Atoms	18
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	238.33
LogP ≤ 5	3.76
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine?

The IUPAC name of 4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine (CID 146613279) is 4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine.

What is the SMILES notation for 4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine?

The canonical SMILES for 4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine is CC(C)c1c(-c2ccncc2)cnc2c1CCC2.

What is the InChIKey of 4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine?

The InChIKey is VOPCUFVAEPUCPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2/c1-11(2)16-13-4-3-5-15(13)18-10-14(16)12-6-8-17-9-7-12/h6-11H,3-5H2,1-2H3.

What are the key properties of 4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine?

4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine has a molecular weight of 238.33 g/mol, XLogP of 3.76, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 4-propan-2-yl-3-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridine is sourced from PubChem (CID 146613279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 146613279 — identifiers, structure, computed properties (public domain)

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