Spiro[1,2-dihydropyrrolo[2,3-c]pyridine-3,1'-cyclopropane]
CAS No.：
Cat. No.: SC251209
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Product Name :Spiro[1,2-dihydropyrrolo[2,3-c]pyridine-3,1'-cyclopropane]
Cat. No.: :SC251209
Purity / Specification :—
CAS No. :1823898-48-1
MDL No. :—
Molecular Formula :C9H10N2
LogP :1.20
Molecular Weight :146.19
TPSA :24.9
Category :CRO / Contract Research
HSN Code :—
SMILES Code :C1CC12CNC3=C2C=CN=C3
Melting Point :—
InChI Key : :NWJJXEHXIOHBBN-UHFFFAOYSA-N
Boiling Point :No data available
Application Note
AI GeneratedGenerated by AI. Verify before use in regulatory documents.
Lipinski & ADMET Properties
Computational estimateLipinski Rule of 5
iMW ≤ 500 Da✓ 146.2 Da
LogP ≤ 5✓ 1.20
HBD ≤ 5✓ 1
HBA ≤ 10✓ 2
Max 1 violation allowed for oral bioavailability.
Drug-likeness Score
i58/100
Moderate — typical building block
Predicted LogP
i1.20log units
Optimal range (0–3)
CNS Permeability
iClark model · J Pharm Sci, 1999
CNS+ likely
TPSA 24.9Ų · Threshold: <60 CNS+ · 60–90 CNS± · >90 CNS−
Requires experimental confirmation.
⚠ These are computational estimates based on Lipinski & Veber physicochemical rules. They are not validated ADMET predictions and must not be used for clinical, regulatory, or safety decisions. For research use only.