N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide

C20H15N5O — CID 52880425

IUPACN-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(Nc1ccc(/N=N/c2ccccc2)cc1)c1ccc2nccn2c1
InChIInChI=1S/C20H15N5O/c26-20(15-6-11-19-21-12-13-25(19)14-15)22-16-7-9-18(10-8-16)24-23-17-4-2-1-3-5-17/h1-14H,(H,22,26)/b24-23+
InChIKeyKKWMCCFOEOZDRJ-WCWDXBQESA-N
MW341.37 g/mol
LogP5.00
Rot. Bonds4

About N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide

N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 52880425) has the molecular formula C20H15N5O and a molecular weight of 341.37 g/mol. Its IUPAC name is N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID52880425
Molecular FormulaC20H15N5O
Molecular Weight341.37 g/mol
Exact Mass341.13
IUPAC NameN-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(Nc1ccc(/N=N/c2ccccc2)cc1)c1ccc2nccn2c1
InChIInChI=1S/C20H15N5O/c26-20(15-6-11-19-21-12-13-25(19)14-15)22-16-7-9-18(10-8-16)24-23-17-4-2-1-3-5-17/h1-14H,(H,22,26)/b24-23+
InChIKeyKKWMCCFOEOZDRJ-WCWDXBQESA-N
XLogP5.00
TPSA71.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.37
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide (CID 52880425) is N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide is O=C(Nc1ccc(/N=N/c2ccccc2)cc1)c1ccc2nccn2c1.
What is the InChIKey of N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is KKWMCCFOEOZDRJ-WCWDXBQESA-N. The full InChI is InChI=1S/C20H15N5O/c26-20(15-6-11-19-21-12-13-25(19)14-15)22-16-7-9-18(10-8-16)24-23-17-4-2-1-3-5-17/h1-14H,(H,22,26)/b24-23+.
What are the key properties of N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide?
N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 341.37 g/mol, XLogP of 5.00, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 52880425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).