3-aminooxolane-3-carboxamide
CAS No.：
Cat. No.: SC25846
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Product Name :3-aminooxolane-3-carboxamide
Cat. No.: :SC25846
Purity / Specification :—
CAS No. :1342406-32-9
MDL No. :MFCD18333657
Molecular Formula :C5H10N2O2
LogP :-1.90
Molecular Weight :130.15
TPSA :78.3
Category :Building Blocks
HSN Code :—
SMILES Code :C1COCC1(C(=O)N)N
Melting Point :—
InChI Key : :UYZGJJIHZKHDTQ-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✓ 130.1 Da
LogP ≤ 5✓ -1.90
HBD ≤ 5✓ 2
HBA ≤ 10✓ 3
Max 1 violation allowed for oral bioavailability.
Drug-likeness Score
i47/100
Fragment / low drug-likeness
Predicted LogP
i-1.90log units
Hydrophilic
CNS Permeability
iClark model · J Pharm Sci, 1999
CNS± borderline
TPSA 78.3Ų · 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.