1-propanoyl-3H-indol-2-one

HCID 323728

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Basic information

CAS: 68641-02-1
Standard SMILES: CCC(=O)N1C(=O)Cc2ccccc21
InChIKey: DRPQUDCXNJBYFE-UHFFFAOYSA-N
Molecular formula: C11H11NO2
Average molar mass: 189.21 g/mol
Monoisotopic mass: 189.07897859

Names & identifiers

Preferred name: 1-propanoyl-3H-indol-2-one
IUPAC: 1-propanoyl-3H-indol-2-one

Names & synonyms

1-propanoyl-3H-indol-2-one68641-02-1DTXSID30314602RefChem:235021DTXCID70265725NSC286437SCHEMBL17169390NSC-2864371-Propanoyl-1,3-dihydro-2H-indol-2-oneDS-0133302H-INDOL-2-ONE,1,3-DIHYDRO-1-(1-OXOPROPYL)-

Database identifiers

CAS: 68641-02-1
PubChem CID: 323728
DTXSID: DTXSID30314602
Nikkaji: J3.643.054K

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 37.4 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 14
Formal charge: 0
Complexity: 262

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