Indeno(2,1-b)pyrrol-8(1H)-one, 3-((dimethylamino)methyl)-2-methyl-1-(phenylmethyl)-
Basic information
- CAS
126581-73-5- Standard SMILES
Cc1c(CN(C)C)c2c(n1Cc1ccccc1)C(=O)c1ccccc1-2- InChIKey
GMSJLIWEQRALHY-UHFFFAOYSA-N- Molecular formula
- C22H22N2O
- Average molar mass
- 330.4 g/mol
- Monoisotopic mass
- 330.17321333
Names & identifiers
- Preferred name
- Indeno(2,1-b)pyrrol-8(1H)-one, 3-((dimethylamino)methyl)-2-methyl-1-(phenylmethyl)-
- IUPAC
- 3-benzyl-1-[(dimethylamino)methyl]-2-methylindeno[2,1-b]pyrrol-4-one
Names & synonyms
126581-73-5BRN 4237273Indeno(2,1-b)pyrrol-8(1H)-one, 3-((dimethylamino)methyl)-2-methyl-1-(phenylmethyl)-DTXSID501552363-((Dimethylamino)methyl)-2-methyl-1-(phenylmethyl)indeno(2,1-b)pyrrol-8(1H)-oneRefChem:349090DTXCID5077727Indeno[2,1-b]pyrrol-8(1H)-one,3-[(dimethylamino)methyl]-2-methyl-1-(phenylmethyl)-1-benzyl-3-[(dimethylamino)methyl]-2-methylindeno[2,1-b]pyrrol-8(1H)-oneCBMicro_021561Oprea1_035831Oprea1_419736
Show more names
CHEMBL1626446STL056938AKOS005709702NCGC00245331-011-benzyl-3-[(dimethylamino)methyl]-2-methylindeno[2,1-b]pyrrol-8(1H)-one--hydrogen chloride (1/1)
Database identifiers
- CAS
126581-73-5- PubChem CID
- 216356
- DTXSID
DTXSID50155236- ChEMBL
CHEMBL1626446
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 25.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 484
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Compound notes
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