Fenoterol

C₁₇H₂₁NO₄ — CID 3343

About Fenoterol

Fenoterol (PubChem CID 3343) has the molecular formula C₁₇H₂₁NO₄ and a molecular weight of 303.36 g/mol. Its IUPAC name is 5-[1-hydroxy-2-[1-(4-hydroxyphenyl)propan-2-ylamino]ethyl]benzene-1,3-diol.

Molecular Properties

• Compound Name: Fenoterol
• PubChem CID: 3343
• Molecular Formula: C₁₇H₂₁NO₄
• Molecular Weight: 303.36 g/mol
• Exact Mass: 303.15
• IUPAC Name: 5-[1-hydroxy-2-[1-(4-hydroxyphenyl)propan-2-ylamino]ethyl]benzene-1,3-diol
• SMILES: CC(Cc1ccc(O)cc1)NCC(O)c1cc(O)cc(O)c1
• InChI: InChI=1S/C17H21NO4/c1-11(6-12-2-4-14(19)5-3-12)18-10-17(22)13-7-15(20)9-16(21)8-13/h2-5,7-9,11,17-22H,6,10H2,1H3
• InChIKey: LSLYOANBFKQKPT-UHFFFAOYSA-N
• XLogP: 2.06
• TPSA: 92.95 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 22
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	303.36
LogP ≤ 5	2.06
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of Fenoterol?

The IUPAC name of Fenoterol (CID 3343) is 5-[1-hydroxy-2-[1-(4-hydroxyphenyl)propan-2-ylamino]ethyl]benzene-1,3-diol.

What is the SMILES notation for Fenoterol?

The canonical SMILES for Fenoterol is CC(Cc1ccc(O)cc1)NCC(O)c1cc(O)cc(O)c1.

What is the InChIKey of Fenoterol?

The InChIKey is LSLYOANBFKQKPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO4/c1-11(6-12-2-4-14(19)5-3-12)18-10-17(22)13-7-15(20)9-16(21)8-13/h2-5,7-9,11,17-22H,6,10H2,1H3.

What are the key properties of Fenoterol?

Fenoterol has a molecular weight of 303.36 g/mol, XLogP of 2.06, 6 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for Fenoterol is sourced from PubChem (CID 3343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 3343 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 1155 — approved-drug record (CC BY-SA 4.0)

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