Basic information
- CAS
64140-52-9- Standard SMILES
CC1Cc2ccccc2N1C(=O)CN1CCCCC1- InChIKey
KLRQEEOAFPCZJN-UHFFFAOYSA-N- Molecular formula
- C16H22N2O
- Average molar mass
- 258.36 g/mol
- Monoisotopic mass
- 258.17321333
Names & identifiers
- Preferred name
- 1-(2-Methyl-2,3-dihydro-1H-indol-1-yl)-2-(piperidin-1-yl)ethan-1-onato
- IUPAC
- 1-(2-methyl-2,3-dihydroindol-1-yl)-2-piperidin-1-ylethanone
Names & synonyms
64140-52-9DTXSID109826461-(2-Methyl-2,3-dihydro-1H-indol-1-yl)-2-(piperidin-1-yl)ethan-1-onatoRefChem:1054009DTXCID2014099062-Methyl-1-piperidinoacetylindolineBRN 1649438INDOLINE, 2-METHYL-1-PIPERIDINOACETYL-5-20-06-00346 (Beilstein Handbook Reference)CHEMBL2220644KLRQEEOAFPCZJN-UHFFFAOYSA-NSTK522433
Show more names
AKOS005455491NCGC00245906-01ST0959681-(2-methylindolinyl)-2-piperidylethan-1-one1-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-(piperidin-1-yl)ethanoneEthanone, 1-(2-methyl-2,3-dihydroindol-1-yl)-2-(piperidin-1-yl)-1-(2-METHYL-2,3-DIHYDRO-1H-INDOL-1-YL)-2-(PIPERIDIN-1-YL)ETHAN-1-ONE
Database identifiers
- CAS
64140-52-9- PubChem CID
- 43095
- DTXSID
DTXSID10982646- ChEMBL
CHEMBL2220644
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…