Propazol

C₁₀H₁₀N₂O₂ — CID 4739544

About Propazol

Propazol (PubChem CID 4739544) has the molecular formula C₁₀H₁₀N₂O₂ and a molecular weight of 190.20 g/mol. Its IUPAC name is 3-(1H-benzimidazol-3-ium-2-yl)propanoate.

Molecular Properties

• Compound Name: Propazol
• PubChem CID: 4739544
• Molecular Formula: C₁₀H₁₀N₂O₂
• Molecular Weight: 190.20 g/mol
• Exact Mass: 190.07
• IUPAC Name: 3-(1H-benzimidazol-3-ium-2-yl)propanoate
• SMILES: O=C([O-])CCc1[nH]c2ccccc2[nH+]1
• InChI: InChI=1S/C10H10N2O2/c13-10(14)6-5-9-11-7-3-1-2-4-8(7)12-9/h1-4H,5-6H2,(H,11,12)(H,13,14)
• InChIKey: XYWJNTOURDMTPI-UHFFFAOYSA-N
• XLogP: -0.34
• TPSA: 70.06 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 3
• Heavy Atoms: 14
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	190.20
LogP ≤ 5	-0.34
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of Propazol?

The IUPAC name of Propazol (CID 4739544) is 3-(1H-benzimidazol-3-ium-2-yl)propanoate.

What is the SMILES notation for Propazol?

The canonical SMILES for Propazol is O=C([O-])CCc1[nH]c2ccccc2[nH+]1.

What is the InChIKey of Propazol?

The InChIKey is XYWJNTOURDMTPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c13-10(14)6-5-9-11-7-3-1-2-4-8(7)12-9/h1-4H,5-6H2,(H,11,12)(H,13,14).

What are the key properties of Propazol?

Propazol has a molecular weight of 190.20 g/mol, XLogP of -0.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for Propazol is sourced from PubChem (CID 4739544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 4739544 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 2275 — approved-drug record (CC BY-SA 4.0)

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