N-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide

C15H12N4O — CID 44726099

IUPACN-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(N/N=C/c1ccccc1)c1cn2ccccc2n1
InChIInChI=1S/C15H12N4O/c20-15(18-16-10-12-6-2-1-3-7-12)13-11-19-9-5-4-8-14(19)17-13/h1-11H,(H,18,20)/b16-10+
InChIKeyWCPWTQSYGJUZKB-MHWRWJLKSA-N
MW264.29 g/mol
LogP2.10
Rot. Bonds3

About N-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide

N-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 44726099) has the molecular formula C15H12N4O and a molecular weight of 264.29 g/mol. Its IUPAC name is N-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID44726099
Molecular FormulaC15H12N4O
Molecular Weight264.29 g/mol
Exact Mass264.10
IUPAC NameN-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(N/N=C/c1ccccc1)c1cn2ccccc2n1
InChIInChI=1S/C15H12N4O/c20-15(18-16-10-12-6-2-1-3-7-12)13-11-19-9-5-4-8-14(19)17-13/h1-11H,(H,18,20)/b16-10+
InChIKeyWCPWTQSYGJUZKB-MHWRWJLKSA-N
XLogP2.10
TPSA58.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 52.10
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-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide (CID 44726099) is N-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide is O=C(N/N=C/c1ccccc1)c1cn2ccccc2n1.
What is the InChIKey of N-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is WCPWTQSYGJUZKB-MHWRWJLKSA-N. The full InChI is InChI=1S/C15H12N4O/c20-15(18-16-10-12-6-2-1-3-7-12)13-11-19-9-5-4-8-14(19)17-13/h1-11H,(H,18,20)/b16-10+.
What are the key properties of N-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide?
N-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 264.29 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-benzylideneamino]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 44726099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).