(E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine

C25H19N3O2 — CID 142505396

IUPAC(E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine
SMILESC(=N/OC1Cc2ccccc2C1)\c1c(-c2ccc3ccccc3c2)nc2occn12
InChIInChI=1S/C25H19N3O2/c1-2-6-18-13-21(10-9-17(18)5-1)24-23(28-11-12-29-25(28)27-24)16-26-30-22-14-19-7-3-4-8-20(19)15-22/h1-13,16,22H,14-15H2/b26-16+
InChIKeyCRQDSRXCPJYGDB-WGOQTCKBSA-N
MW393.45 g/mol
LogP5.27
Rot. Bonds4

About (E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine

(E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine (PubChem CID 142505396) has the molecular formula C25H19N3O2 and a molecular weight of 393.45 g/mol. Its IUPAC name is (E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine.

Molecular Properties

Compound Name(E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine
PubChem CID142505396
Molecular FormulaC25H19N3O2
Molecular Weight393.45 g/mol
Exact Mass393.15
IUPAC Name(E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine
SMILESC(=N/OC1Cc2ccccc2C1)\c1c(-c2ccc3ccccc3c2)nc2occn12
InChIInChI=1S/C25H19N3O2/c1-2-6-18-13-21(10-9-17(18)5-1)24-23(28-11-12-29-25(28)27-24)16-26-30-22-14-19-7-3-4-8-20(19)15-22/h1-13,16,22H,14-15H2/b26-16+
InChIKeyCRQDSRXCPJYGDB-WGOQTCKBSA-N
XLogP5.27
TPSA52.03 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.45
LogP ≤ 55.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine?
The IUPAC name of (E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine (CID 142505396) is (E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine.
What is the SMILES notation for (E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine?
The canonical SMILES for (E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine is C(=N/OC1Cc2ccccc2C1)\c1c(-c2ccc3ccccc3c2)nc2occn12.
What is the InChIKey of (E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine?
The InChIKey is CRQDSRXCPJYGDB-WGOQTCKBSA-N. The full InChI is InChI=1S/C25H19N3O2/c1-2-6-18-13-21(10-9-17(18)5-1)24-23(28-11-12-29-25(28)27-24)16-26-30-22-14-19-7-3-4-8-20(19)15-22/h1-13,16,22H,14-15H2/b26-16+.
What are the key properties of (E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine?
(E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine has a molecular weight of 393.45 g/mol, XLogP of 5.27, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine is sourced from PubChem (CID 142505396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).