2-(5-fluoroindazol-1-yl)ethyl acetate

Name: 2-(5-fluoroindazol-1-yl)ethyl acetate — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₁H₁₁FN₂O₂ — CID 151811736

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC2-(5-fluoroindazol-1-yl)ethyl acetate

SMILESCC(=O)OCCn1ncc2cc(F)ccc21

InChIInChI=1S/C11H11FN2O2/c1-8(15)16-5-4-14-11-3-2-10(12)6-9(11)7-13-14/h2-3,6-7H,4-5H2,1H3

InChIKeySATHCDLQFFBPMJ-UHFFFAOYSA-N

MW222.22 g/mol

LogP1.74

Rot. Bonds3

About 2-(5-fluoroindazol-1-yl)ethyl acetate

2-(5-fluoroindazol-1-yl)ethyl acetate (PubChem CID 151811736) has the molecular formula C₁₁H₁₁FN₂O₂ and a molecular weight of 222.22 g/mol. Its IUPAC name is 2-(5-fluoroindazol-1-yl)ethyl acetate.

Molecular Properties

Compound Name	2-(5-fluoroindazol-1-yl)ethyl acetate
PubChem CID	151811736
Molecular Formula	C₁₁H₁₁FN₂O₂
Molecular Weight	222.22 g/mol
Exact Mass	222.08
IUPAC Name	2-(5-fluoroindazol-1-yl)ethyl acetate
SMILES	CC(=O)OCCn1ncc2cc(F)ccc21
InChI	InChI=1S/C11H11FN2O2/c1-8(15)16-5-4-14-11-3-2-10(12)6-9(11)7-13-14/h2-3,6-7H,4-5H2,1H3
InChIKey	SATHCDLQFFBPMJ-UHFFFAOYSA-N
XLogP	1.74
TPSA	44.12 Å²
H-Bond Donors
H-Bond Acceptors	4
Rotatable Bonds	3
Heavy Atoms	16
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	222.22
LogP ≤ 5	1.74
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoroindazol-1-yl)ethyl acetate?

The IUPAC name of 2-(5-fluoroindazol-1-yl)ethyl acetate (CID 151811736) is 2-(5-fluoroindazol-1-yl)ethyl acetate.

What is the SMILES notation for 2-(5-fluoroindazol-1-yl)ethyl acetate?

The canonical SMILES for 2-(5-fluoroindazol-1-yl)ethyl acetate is CC(=O)OCCn1ncc2cc(F)ccc21.

What is the InChIKey of 2-(5-fluoroindazol-1-yl)ethyl acetate?

The InChIKey is SATHCDLQFFBPMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O2/c1-8(15)16-5-4-14-11-3-2-10(12)6-9(11)7-13-14/h2-3,6-7H,4-5H2,1H3.

What are the key properties of 2-(5-fluoroindazol-1-yl)ethyl acetate?

2-(5-fluoroindazol-1-yl)ethyl acetate has a molecular weight of 222.22 g/mol, XLogP of 1.74, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(5-fluoroindazol-1-yl)ethyl acetate is sourced from PubChem (CID 151811736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 151811736 — identifiers, structure, computed properties (public domain)

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