Maolate

C₁₀H₁₂ClNO₄ — CID 2724

About Maolate

Maolate (PubChem CID 2724) has the molecular formula C₁₀H₁₂ClNO₄ and a molecular weight of 245.66 g/mol. Its IUPAC name is [3-(4-chlorophenoxy)-2-hydroxypropyl] carbamate.

Molecular Properties

• Compound Name: Maolate
• PubChem CID: 2724
• Molecular Formula: C₁₀H₁₂ClNO₄
• Molecular Weight: 245.66 g/mol
• Exact Mass: 245.05
• IUPAC Name: [3-(4-chlorophenoxy)-2-hydroxypropyl] carbamate
• SMILES: NC(=O)OCC(O)COc1ccc(Cl)cc1
• InChI: InChI=1S/C10H12ClNO4/c11-7-1-3-9(4-2-7)15-5-8(13)6-16-10(12)14/h1-4,8,13H,5-6H2,(H2,12,14)
• InChIKey: SKPLBLUECSEIFO-UHFFFAOYSA-N
• XLogP: 1.17
• TPSA: 81.78 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 16
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	245.66
LogP ≤ 5	1.17
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of Maolate?

The IUPAC name of Maolate (CID 2724) is [3-(4-chlorophenoxy)-2-hydroxypropyl] carbamate.

What is the SMILES notation for Maolate?

The canonical SMILES for Maolate is NC(=O)OCC(O)COc1ccc(Cl)cc1.

What is the InChIKey of Maolate?

The InChIKey is SKPLBLUECSEIFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClNO4/c11-7-1-3-9(4-2-7)15-5-8(13)6-16-10(12)14/h1-4,8,13H,5-6H2,(H2,12,14).

What are the key properties of Maolate?

Maolate has a molecular weight of 245.66 g/mol, XLogP of 1.17, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for Maolate is sourced from PubChem (CID 2724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 2724 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 614 — approved-drug record (CC BY-SA 4.0)

How this page is built: methodology · editorial policy & corrections.