6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide

Name: 6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₄H₁₇N₃O₂ — CID 95402245

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

IUPAC6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide

SMILESCCN(C[C@@H]1CCCO1)C(=O)c1ccc(C#N)nc1

InChIInChI=1S/C14H17N3O2/c1-2-17(10-13-4-3-7-19-13)14(18)11-5-6-12(8-15)16-9-11/h5-6,9,13H,2-4,7,10H2,1H3/t13-/m0/s1

InChIKeyNUDJGUMCZMJRHZ-ZDUSSCGKSA-N

MW259.31 g/mol

LogP1.59

Rot. Bonds4

About 6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide

6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide (PubChem CID 95402245) has the molecular formula C₁₄H₁₇N₃O₂ and a molecular weight of 259.31 g/mol. Its IUPAC name is 6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name	6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide
PubChem CID	95402245
Molecular Formula	C₁₄H₁₇N₃O₂
Molecular Weight	259.31 g/mol
Exact Mass	259.13
IUPAC Name	6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide
SMILES	CCN(C[C@@H]1CCCO1)C(=O)c1ccc(C#N)nc1
InChI	InChI=1S/C14H17N3O2/c1-2-17(10-13-4-3-7-19-13)14(18)11-5-6-12(8-15)16-9-11/h5-6,9,13H,2-4,7,10H2,1H3/t13-/m0/s1
InChIKey	NUDJGUMCZMJRHZ-ZDUSSCGKSA-N
XLogP	1.59
TPSA	66.22 Å²
H-Bond Donors
H-Bond Acceptors	4
Rotatable Bonds	4
Heavy Atoms	19
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	259.31
LogP ≤ 5	1.59
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide?

The IUPAC name of 6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide (CID 95402245) is 6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide.

What is the SMILES notation for 6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide?

The canonical SMILES for 6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide is CCN(C[C@@H]1CCCO1)C(=O)c1ccc(C#N)nc1.

What is the InChIKey of 6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide?

The InChIKey is NUDJGUMCZMJRHZ-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-2-17(10-13-4-3-7-19-13)14(18)11-5-6-12(8-15)16-9-11/h5-6,9,13H,2-4,7,10H2,1H3/t13-/m0/s1.

What are the key properties of 6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide?

6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 1.59, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 6-cyano-N-ethyl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide is sourced from PubChem (CID 95402245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 95402245 — identifiers, structure, computed properties (public domain)

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