5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide

Name: 5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₇H₂₀N₄O — CID 109226474

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

IUPAC5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide

SMILESO=C(NCc1cccnc1)c1cncc(N2CCCCC2)c1

InChIInChI=1S/C17H20N4O/c22-17(20-11-14-5-4-6-18-10-14)15-9-16(13-19-12-15)21-7-2-1-3-8-21/h4-6,9-10,12-13H,1-3,7-8,11H2,(H,20,22)

InChIKeyXNQWTNTYSFPNBH-UHFFFAOYSA-N

MW296.37 g/mol

LogP2.40

Rot. Bonds4

About 5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide

5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide (PubChem CID 109226474) has the molecular formula C₁₇H₂₀N₄O and a molecular weight of 296.37 g/mol. Its IUPAC name is 5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name	5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
PubChem CID	109226474
Molecular Formula	C₁₇H₂₀N₄O
Molecular Weight	296.37 g/mol
Exact Mass	296.16
IUPAC Name	5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
SMILES	O=C(NCc1cccnc1)c1cncc(N2CCCCC2)c1
InChI	InChI=1S/C17H20N4O/c22-17(20-11-14-5-4-6-18-10-14)15-9-16(13-19-12-15)21-7-2-1-3-8-21/h4-6,9-10,12-13H,1-3,7-8,11H2,(H,20,22)
InChIKey	XNQWTNTYSFPNBH-UHFFFAOYSA-N
XLogP	2.40
TPSA	58.12 Å²
H-Bond Donors	1
H-Bond Acceptors	4
Rotatable Bonds	4
Heavy Atoms	22
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	296.37
LogP ≤ 5	2.40
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?

The IUPAC name of 5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide (CID 109226474) is 5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide.

What is the SMILES notation for 5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?

The canonical SMILES for 5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide is O=C(NCc1cccnc1)c1cncc(N2CCCCC2)c1.

What is the InChIKey of 5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?

The InChIKey is XNQWTNTYSFPNBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c22-17(20-11-14-5-4-6-18-10-14)15-9-16(13-19-12-15)21-7-2-1-3-8-21/h4-6,9-10,12-13H,1-3,7-8,11H2,(H,20,22).

What are the key properties of 5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?

5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide has a molecular weight of 296.37 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 5-piperidin-1-yl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 109226474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 109226474 — identifiers, structure, computed properties (public domain)

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