4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one

C10H11FN2O2 — CID 10703634

IUPAC4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one
SMILESNCCOc1ccc(F)c2c1CC(=O)N2
InChIInChI=1S/C10H11FN2O2/c11-7-1-2-8(15-4-3-12)6-5-9(14)13-10(6)7/h1-2H,3-5,12H2,(H,13,14)
InChIKeySGAXOBUAZNCOOR-UHFFFAOYSA-N
MW210.21 g/mol
LogP0.66
Rot. Bonds3

About 4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one

4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one (PubChem CID 10703634) has the molecular formula C10H11FN2O2 and a molecular weight of 210.21 g/mol. Its IUPAC name is 4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one
PubChem CID10703634
Molecular FormulaC10H11FN2O2
Molecular Weight210.21 g/mol
Exact Mass210.08
IUPAC Name4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one
SMILESNCCOc1ccc(F)c2c1CC(=O)N2
InChIInChI=1S/C10H11FN2O2/c11-7-1-2-8(15-4-3-12)6-5-9(14)13-10(6)7/h1-2H,3-5,12H2,(H,13,14)
InChIKeySGAXOBUAZNCOOR-UHFFFAOYSA-N
XLogP0.66
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one?
The IUPAC name of 4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one (CID 10703634) is 4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one.
What is the SMILES notation for 4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one?
The canonical SMILES for 4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one is NCCOc1ccc(F)c2c1CC(=O)N2.
What is the InChIKey of 4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one?
The InChIKey is SGAXOBUAZNCOOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2O2/c11-7-1-2-8(15-4-3-12)6-5-9(14)13-10(6)7/h1-2H,3-5,12H2,(H,13,14).
What are the key properties of 4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one?
4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one has a molecular weight of 210.21 g/mol, XLogP of 0.66, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminoethoxy)-7-fluoro-1,3-dihydroindol-2-one is sourced from PubChem (CID 10703634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).