6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one

C14H10FIN2O — CID 43124339

IUPAC6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one
SMILESO=C1Nc2cc(F)ccc2C1Nc1ccc(I)cc1
InChIInChI=1S/C14H10FIN2O/c15-8-1-6-11-12(7-8)18-14(19)13(11)17-10-4-2-9(16)3-5-10/h1-7,13,17H,(H,18,19)
InChIKeyQVEKDVSFDOGNGE-UHFFFAOYSA-N
MW368.15 g/mol
LogP3.54
Rot. Bonds2

About 6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one

6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one (PubChem CID 43124339) has the molecular formula C14H10FIN2O and a molecular weight of 368.15 g/mol. Its IUPAC name is 6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one
PubChem CID43124339
Molecular FormulaC14H10FIN2O
Molecular Weight368.15 g/mol
Exact Mass367.98
IUPAC Name6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one
SMILESO=C1Nc2cc(F)ccc2C1Nc1ccc(I)cc1
InChIInChI=1S/C14H10FIN2O/c15-8-1-6-11-12(7-8)18-14(19)13(11)17-10-4-2-9(16)3-5-10/h1-7,13,17H,(H,18,19)
InChIKeyQVEKDVSFDOGNGE-UHFFFAOYSA-N
XLogP3.54
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.15
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one?
The IUPAC name of 6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one (CID 43124339) is 6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one?
The canonical SMILES for 6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one is O=C1Nc2cc(F)ccc2C1Nc1ccc(I)cc1.
What is the InChIKey of 6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one?
The InChIKey is QVEKDVSFDOGNGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FIN2O/c15-8-1-6-11-12(7-8)18-14(19)13(11)17-10-4-2-9(16)3-5-10/h1-7,13,17H,(H,18,19).
What are the key properties of 6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one?
6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one has a molecular weight of 368.15 g/mol, XLogP of 3.54, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-(4-iodoanilino)-1,3-dihydroindol-2-one is sourced from PubChem (CID 43124339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).