N-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide

C12H11N3O2 — CID 5402012

IUPACN-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide
SMILESC/C(=N/NC(=O)c1ccccn1)c1ccco1
InChIInChI=1S/C12H11N3O2/c1-9(11-6-4-8-17-11)14-15-12(16)10-5-2-3-7-13-10/h2-8H,1H3,(H,15,16)/b14-9-
InChIKeyRIALSAWSDNZIDK-ZROIWOOFSA-N
MW229.24 g/mol
LogP1.83
Rot. Bonds3

About N-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide

N-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide (PubChem CID 5402012) has the molecular formula C12H11N3O2 and a molecular weight of 229.24 g/mol. Its IUPAC name is N-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide
PubChem CID5402012
Molecular FormulaC12H11N3O2
Molecular Weight229.24 g/mol
Exact Mass229.09
IUPAC NameN-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide
SMILESC/C(=N/NC(=O)c1ccccn1)c1ccco1
InChIInChI=1S/C12H11N3O2/c1-9(11-6-4-8-17-11)14-15-12(16)10-5-2-3-7-13-10/h2-8H,1H3,(H,15,16)/b14-9-
InChIKeyRIALSAWSDNZIDK-ZROIWOOFSA-N
XLogP1.83
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide?
The IUPAC name of N-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide (CID 5402012) is N-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide.
What is the SMILES notation for N-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide?
The canonical SMILES for N-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide is C/C(=N/NC(=O)c1ccccn1)c1ccco1.
What is the InChIKey of N-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide?
The InChIKey is RIALSAWSDNZIDK-ZROIWOOFSA-N. The full InChI is InChI=1S/C12H11N3O2/c1-9(11-6-4-8-17-11)14-15-12(16)10-5-2-3-7-13-10/h2-8H,1H3,(H,15,16)/b14-9-.
What are the key properties of N-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide?
N-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide has a molecular weight of 229.24 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-(furan-2-yl)ethylideneamino]pyridine-2-carboxamide is sourced from PubChem (CID 5402012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).