Hydroxyphenamate

C₁₁H₁₅NO₃ — CID 5752

About Hydroxyphenamate

Hydroxyphenamate (PubChem CID 5752) has the molecular formula C₁₁H₁₅NO₃ and a molecular weight of 209.25 g/mol. Its IUPAC name is (2-hydroxy-2-phenylbutyl) carbamate.

Molecular Properties

• Compound Name: Hydroxyphenamate
• PubChem CID: 5752
• Molecular Formula: C₁₁H₁₅NO₃
• Molecular Weight: 209.25 g/mol
• Exact Mass: 209.11
• IUPAC Name: (2-hydroxy-2-phenylbutyl) carbamate
• SMILES: CCC(O)(COC(N)=O)c1ccccc1
• InChI: InChI=1S/C11H15NO3/c1-2-11(14,8-15-10(12)13)9-6-4-3-5-7-9/h3-7,14H,2,8H2,1H3,(H2,12,13)
• InChIKey: WAFIYOULDIWAKR-UHFFFAOYSA-N
• XLogP: 1.38
• TPSA: 72.55 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 3
• Rotatable Bonds: 4
• Heavy Atoms: 15
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	209.25
LogP ≤ 5	1.38
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of Hydroxyphenamate?

The IUPAC name of Hydroxyphenamate (CID 5752) is (2-hydroxy-2-phenylbutyl) carbamate.

What is the SMILES notation for Hydroxyphenamate?

The canonical SMILES for Hydroxyphenamate is CCC(O)(COC(N)=O)c1ccccc1.

What is the InChIKey of Hydroxyphenamate?

The InChIKey is WAFIYOULDIWAKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-2-11(14,8-15-10(12)13)9-6-4-3-5-7-9/h3-7,14H,2,8H2,1H3,(H2,12,13).

What are the key properties of Hydroxyphenamate?

Hydroxyphenamate has a molecular weight of 209.25 g/mol, XLogP of 1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for Hydroxyphenamate is sourced from PubChem (CID 5752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 5752 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 1397 — approved-drug record (CC BY-SA 4.0)

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