5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one

C10H11FN2O — CID 69465743

IUPAC5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one
SMILESCCc1c(N)cc2c(c1F)NC(=O)C2
InChIInChI=1S/C10H11FN2O/c1-2-6-7(12)3-5-4-8(14)13-10(5)9(6)11/h3H,2,4,12H2,1H3,(H,13,14)
InChIKeyVPADXEZAQALUHV-UHFFFAOYSA-N
MW194.21 g/mol
LogP1.46
Rot. Bonds1

About 5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one

5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one (PubChem CID 69465743) has the molecular formula C10H11FN2O and a molecular weight of 194.21 g/mol. Its IUPAC name is 5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one
PubChem CID69465743
Molecular FormulaC10H11FN2O
Molecular Weight194.21 g/mol
Exact Mass194.09
IUPAC Name5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one
SMILESCCc1c(N)cc2c(c1F)NC(=O)C2
InChIInChI=1S/C10H11FN2O/c1-2-6-7(12)3-5-4-8(14)13-10(5)9(6)11/h3H,2,4,12H2,1H3,(H,13,14)
InChIKeyVPADXEZAQALUHV-UHFFFAOYSA-N
XLogP1.46
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.21
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one?
The IUPAC name of 5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one (CID 69465743) is 5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one?
The canonical SMILES for 5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one is CCc1c(N)cc2c(c1F)NC(=O)C2.
What is the InChIKey of 5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one?
The InChIKey is VPADXEZAQALUHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2O/c1-2-6-7(12)3-5-4-8(14)13-10(5)9(6)11/h3H,2,4,12H2,1H3,(H,13,14).
What are the key properties of 5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one?
5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one has a molecular weight of 194.21 g/mol, XLogP of 1.46, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-ethyl-7-fluoro-1,3-dihydroindol-2-one is sourced from PubChem (CID 69465743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).