3-(1H-Pyrrol-1-yl)indolin-2-one

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Basic information

CAS: 16176-35-5
Standard SMILES: O=C1Nc2ccccc2C1n1cccc1
InChIKey: BBGWUWFDIBQIBE-UHFFFAOYSA-N
Molecular formula: C12H10N2O
Average molar mass: 198.22 g/mol
Monoisotopic mass: 198.07931295

Names & identifiers

Preferred name: 3-(1H-Pyrrol-1-yl)indolin-2-one
IUPAC: 3-pyrrol-1-yl-1,3-dihydroindol-2-one

Names & synonyms

3-(1H-Pyrrol-1-yl)indolin-2-one16176-35-5DTXSID10461587RefChem:273346DTXCID404124063-pyrrol-1-yl-1,3-dihydroindol-2-oneSCHEMBL27075570SB652093-(1H-Pyrrol-1-yl)-1,3-dihydro-2H-indol-2-one

Database identifiers

CAS: 16176-35-5
PubChem CID: 11298552
DTXSID: DTXSID10461587
Nikkaji: J2.179.321C

Properties

Computed structural properties

XLogP: 1.4
Topological polar surface area: 34 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 15
Formal charge: 0
Complexity: 260

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Compound notes

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