5-(2-iodobenzoyl)-1,3-dihydroindol-2-one

C15H10INO2 — CID 43338616

IUPAC5-(2-iodobenzoyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(C(=O)c3ccccc3I)ccc2N1
InChIInChI=1S/C15H10INO2/c16-12-4-2-1-3-11(12)15(19)9-5-6-13-10(7-9)8-14(18)17-13/h1-7H,8H2,(H,17,18)
InChIKeyVAKGTGHUUXPAEZ-UHFFFAOYSA-N
MW363.15 g/mol
LogP3.02
Rot. Bonds2

About 5-(2-iodobenzoyl)-1,3-dihydroindol-2-one

5-(2-iodobenzoyl)-1,3-dihydroindol-2-one (PubChem CID 43338616) has the molecular formula C15H10INO2 and a molecular weight of 363.15 g/mol. Its IUPAC name is 5-(2-iodobenzoyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-(2-iodobenzoyl)-1,3-dihydroindol-2-one
PubChem CID43338616
Molecular FormulaC15H10INO2
Molecular Weight363.15 g/mol
Exact Mass362.98
IUPAC Name5-(2-iodobenzoyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(C(=O)c3ccccc3I)ccc2N1
InChIInChI=1S/C15H10INO2/c16-12-4-2-1-3-11(12)15(19)9-5-6-13-10(7-9)8-14(18)17-13/h1-7H,8H2,(H,17,18)
InChIKeyVAKGTGHUUXPAEZ-UHFFFAOYSA-N
XLogP3.02
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.15
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-(2-methylbenzoyl)-1,3-dihydroindol-2-one
CID 43160618
5-(2,3-dimethylbenzoyl)-1,3-dihydroindol-2-one
CID 43160594
5-(4-bromo-2-methylbenzoyl)-1,3-dihydroindol-2-one
CID 43629644
5-(3,5-difluorobenzoyl)-1,3-dihydroindol-2-one
CID 43338600
6-chloro-5-(3-chloro-4-iodobenzoyl)-1,3-dihydroindol-2-one
CID 103219673
5-(4-ethylbenzoyl)-1,3-dihydroindol-2-one
CID 43338587
5-(1H-pyrazole-4-carbonyl)-1,3-dihydroindol-2-one
CID 114988363
N-[3-(2-oxo-1,3-dihydroindole-5-carbonyl)phenyl]acetamide
CID 68698490
6-benzoyl-1,3-dihydroindol-2-one
CID 13408231
5-(2,2-dimethylpropanoyl)-1,3-dihydroindol-2-one
CID 43160600
2-oxo-1,3-dihydroindole-5-carbonyl cyanide
CID 116918958
5-(2,2,2-trifluoroacetyl)-1,3-dihydroindol-2-one
CID 80503823

Frequently Asked Questions

What is the IUPAC name of 5-(2-iodobenzoyl)-1,3-dihydroindol-2-one?
The IUPAC name of 5-(2-iodobenzoyl)-1,3-dihydroindol-2-one (CID 43338616) is 5-(2-iodobenzoyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-(2-iodobenzoyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 5-(2-iodobenzoyl)-1,3-dihydroindol-2-one is O=C1Cc2cc(C(=O)c3ccccc3I)ccc2N1.
What is the InChIKey of 5-(2-iodobenzoyl)-1,3-dihydroindol-2-one?
The InChIKey is VAKGTGHUUXPAEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10INO2/c16-12-4-2-1-3-11(12)15(19)9-5-6-13-10(7-9)8-14(18)17-13/h1-7H,8H2,(H,17,18).
What are the key properties of 5-(2-iodobenzoyl)-1,3-dihydroindol-2-one?
5-(2-iodobenzoyl)-1,3-dihydroindol-2-one has a molecular weight of 363.15 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-iodobenzoyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 43338616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).