Basic information
- CAS
30256-73-6- Standard SMILES
O=C(CN1CCCCC1)c1c[nH]c2ccccc12- InChIKey
CDRQAUBCVZVLOJ-UHFFFAOYSA-N- Molecular formula
- C15H18N2O
- Average molar mass
- 242.32 g/mol
- Monoisotopic mass
- 242.1419132
Names & identifiers
- Preferred name
- 1-(1H-Indol-3-yl)-2-(1-piperidinyl)ethanone
- IUPAC
- 1-(1H-indol-3-yl)-2-piperidin-1-ylethanone
Names & synonyms
30256-73-6KETONE, 3-INDOLYL PIPERIDINOMETHYL1-(1H-indol-3-yl)-2-(1-piperidinyl)ethanoneDTXSID50184349RefChem:1053787DTXCID101068401-(1H-Indol-3-yl)-2-piperidin-1-yl-ethanone1-(1H-indol-3-yl)-2-(piperidin-1-yl)ethanoneBRN 0479623Indolyl-3-piperidinomethyl ketone1-(1H-indol-3-yl)-2-piperidin-1-ylethanone3-(N-piperidyl)acetylindole
Show more names
MLS0012105331-(1H-indol-3-yl)-2-(piperidin-1-yl)ethan-1-oneSCHEMBL1413908SCHEMBL6016069CHEMBL1353722CDRQAUBCVZVLOJ-UHFFFAOYSA-NHMS2837K09HMS3428H18
Database identifiers
- CAS
30256-73-6- PubChem CID
- 34864
- DTXSID
DTXSID50184349- ChEMBL
CHEMBL1353722- Nikkaji
- J62.516G
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 36.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 299
Experimental & physicochemical properties
Solubility>36.3 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
3 records
Compound notes
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