4-methoxy-N-methylpyridin-2-amine
CAS No.：
Cat. No.: SC24569
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Product Name :4-methoxy-N-methylpyridin-2-amine
Cat. No.: :SC24569
Purity / Specification :—
CAS No. :1104455-24-4
MDL No. :MFCD0983485
Molecular Formula :C7H10N2O
LogP :1.10
Molecular Weight :138.17
TPSA :34.2
Category :Building Blocks
HSN Code :—
SMILES Code :CNc1cc(OC)ccn1
Melting Point :—
InChI Key : :SMTQFLZEYWPDEZ-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✓ 138.2 Da
LogP ≤ 5✓ 1.10
HBD ≤ 5✓ 1
HBA ≤ 10✓ 3
Max 1 violation allowed for oral bioavailability.
Drug-likeness Score
i61/100
Moderate — typical building block
Predicted LogP
i1.10log units
Optimal range (0–3)
CNS Permeability
iClark model · J Pharm Sci, 1999
CNS+ likely
TPSA 34.2Ų · 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.