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6-Methylspiro[chromane-2,4'-piperidin]-4-one

HCID 16643147
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1ccc2c(c1)C(=O)CC1(CCNCC1)O2
InChIKey
ZXJOTYBVPLUTPS-UHFFFAOYSA-N
Molecular formula
C14H17NO2
Average molar mass
231.29 g/mol

Names & identifiers

Preferred name
6-Methylspiro[chromane-2,4'-piperidin]-4-one
IUPAC
6-methylspiro[3H-chromene-2,4'-piperidine]-4-one

Names & synonyms

6-Methylspiro[chromane-2,4'-piperidin]-4-one6-methyl-3,4-dihydrospiro[1-benzopyran-2,4'-piperidin]-4-oneSCHEMBL42578566-methylspiro[chroman-2,4'-piperidine]-4-one; HCL saltMFCD09262408AKOS002674439CCG-210194PS-0071ASN 10022166CS-0314568W118406-methylspiro[chromane-2,4'-piperidine]-4-one
Show more names
SR-01000376221SR-01000376221-16-Methyl-spiro[chromene-2,4'-piperidin]-4-(3H)-one

Database identifiers

PubChem CID
16643147

Properties

Computed structural propertiesFilling in

XLogP
1.7
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
17
Formal charge
0
Complexity
309

Related reactions

1 records
New reaction record
HRID 155827 reaction equation
HRID 155827As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes