N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

C30H23N5O — CID 6250185

About N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 6250185) has the molecular formula C30H23N5O and a molecular weight of 469.55 g/mol. Its IUPAC name is N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
• PubChem CID: 6250185
• Molecular Formula: C30H23N5O
• Molecular Weight: 469.55 g/mol
• Exact Mass: 469.19
• IUPAC Name: N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
• SMILES: Cc1nc2ccccn2c1C(=O)N/N=C\c1c(-c2ccccc2)n(-c2ccccc2)c2ccccc12
• InChI: InChI=1S/C30H23N5O/c1-21-28(34-19-11-10-18-27(34)32-21)30(36)33-31-20-25-24-16-8-9-17-26(24)35(23-14-6-3-7-15-23)29(25)22-12-4-2-5-13-22/h2-20H,1H3,(H,33,36)/b31-20-
• InChIKey: DNGXMOKYSDRHOI-GTWSWNCMSA-N
• XLogP: 6.02
• TPSA: 63.69 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	469.55
LogP ≤ 5	6.02
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?

The IUPAC name of N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 6250185) is N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.

What is the SMILES notation for N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?

The canonical SMILES for N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is Cc1nc2ccccn2c1C(=O)N/N=C\c1c(-c2ccccc2)n(-c2ccccc2)c2ccccc12.

What is the InChIKey of N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?

The InChIKey is DNGXMOKYSDRHOI-GTWSWNCMSA-N. The full InChI is InChI=1S/C30H23N5O/c1-21-28(34-19-11-10-18-27(34)32-21)30(36)33-31-20-25-24-16-8-9-17-26(24)35(23-14-6-3-7-15-23)29(25)22-12-4-2-5-13-22/h2-20H,1H3,(H,33,36)/b31-20-.

What are the key properties of N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?

N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 469.55 g/mol, XLogP of 6.02, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 6250185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).