APMP

C₁₄H₁₄N₂O₂ — CID 139597871

About APMP

APMP (PubChem CID 139597871) has the molecular formula C₁₄H₁₄N₂O₂ and a molecular weight of 242.28 g/mol. Its IUPAC name is (3-aminophenyl) N-(3-methylphenyl)carbamate.

Molecular Properties

• Compound Name: APMP
• PubChem CID: 139597871
• Molecular Formula: C₁₄H₁₄N₂O₂
• Molecular Weight: 242.28 g/mol
• Exact Mass: 242.11
• IUPAC Name: (3-aminophenyl) N-(3-methylphenyl)carbamate
• SMILES: Cc1cccc(NC(=O)Oc2cccc(N)c2)c1
• InChI: InChI=1S/C14H14N2O2/c1-10-4-2-6-12(8-10)16-14(17)18-13-7-3-5-11(15)9-13/h2-9H,15H2,1H3,(H,16,17)
• InChIKey: XPSGWCDMGOETNA-UHFFFAOYSA-N
• XLogP: 3.19
• TPSA: 64.35 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 3
• Rotatable Bonds: 2
• Heavy Atoms: 18
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	242.28
LogP ≤ 5	3.19
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aniline', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of APMP?

The IUPAC name of APMP (CID 139597871) is (3-aminophenyl) N-(3-methylphenyl)carbamate.

What is the SMILES notation for APMP?

The canonical SMILES for APMP is Cc1cccc(NC(=O)Oc2cccc(N)c2)c1.

What is the InChIKey of APMP?

The InChIKey is XPSGWCDMGOETNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-10-4-2-6-12(8-10)16-14(17)18-13-7-3-5-11(15)9-13/h2-9H,15H2,1H3,(H,16,17).

What are the key properties of APMP?

APMP has a molecular weight of 242.28 g/mol, XLogP of 3.19, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for APMP is sourced from PubChem (CID 139597871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 139597871 — identifiers, structure, computed properties (public domain)

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