N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide

Name: N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₇H₁₆N₄O₂ — CID 113022851

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

IUPACN-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide

SMILESN#Cc1ccc(Nc2ccc(NC(=O)C3CCCO3)cn2)cc1

InChIInChI=1S/C17H16N4O2/c18-10-12-3-5-13(6-4-12)20-16-8-7-14(11-19-16)21-17(22)15-2-1-9-23-15/h3-8,11,15H,1-2,9H2,(H,19,20)(H,21,22)

InChIKeyJZTSOENFZGNCSG-UHFFFAOYSA-N

MW308.34 g/mol

LogP2.81

Rot. Bonds4

About N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide

N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide (PubChem CID 113022851) has the molecular formula C₁₇H₁₆N₄O₂ and a molecular weight of 308.34 g/mol. Its IUPAC name is N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name	N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide
PubChem CID	113022851
Molecular Formula	C₁₇H₁₆N₄O₂
Molecular Weight	308.34 g/mol
Exact Mass	308.13
IUPAC Name	N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide
SMILES	N#Cc1ccc(Nc2ccc(NC(=O)C3CCCO3)cn2)cc1
InChI	InChI=1S/C17H16N4O2/c18-10-12-3-5-13(6-4-12)20-16-8-7-14(11-19-16)21-17(22)15-2-1-9-23-15/h3-8,11,15H,1-2,9H2,(H,19,20)(H,21,22)
InChIKey	JZTSOENFZGNCSG-UHFFFAOYSA-N
XLogP	2.81
TPSA	87.04 Å²
H-Bond Donors	2
H-Bond Acceptors	5
Rotatable Bonds	4
Heavy Atoms	23
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	308.34
LogP ≤ 5	2.81
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide?

The IUPAC name of N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide (CID 113022851) is N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide.

What is the SMILES notation for N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide?

The canonical SMILES for N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide is N#Cc1ccc(Nc2ccc(NC(=O)C3CCCO3)cn2)cc1.

What is the InChIKey of N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide?

The InChIKey is JZTSOENFZGNCSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O2/c18-10-12-3-5-13(6-4-12)20-16-8-7-14(11-19-16)21-17(22)15-2-1-9-23-15/h3-8,11,15H,1-2,9H2,(H,19,20)(H,21,22).

What are the key properties of N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide?

N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide has a molecular weight of 308.34 g/mol, XLogP of 2.81, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide is sourced from PubChem (CID 113022851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 113022851 — identifiers, structure, computed properties (public domain)

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