1H-Pyrido(4,3-b)indole, 2,3,4,5-tetrahydro-2-isobutyl-8-methyl-5-(2-(6-methyl-3-pyridyl)ethyl)-
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Basic information
- CAS
20674-98-0- Standard SMILES
Cc1ccc2c(c1)c1c(n2CCc2ccc(C)nc2)CCN(CC(C)C)C1- InChIKey
KNMOCSZJXJVVTK-UHFFFAOYSA-N- Molecular formula
- C24H31N3
- Average molar mass
- 361.5 g/mol
- Monoisotopic mass
- 361.251798
Names & identifiers
- Preferred name
- 1H-Pyrido(4,3-b)indole, 2,3,4,5-tetrahydro-2-isobutyl-8-methyl-5-(2-(6-methyl-3-pyridyl)ethyl)-
- IUPAC
- 8-methyl-2-(2-methylpropyl)-5-[2-(6-methyl-3-pyridinyl)ethyl]-3,4-dihydro-1H-pyrido[4,3-b]indole
- English name
- 2,3,4,5-Tetrahydro-2-isobutyl-8-methyl-5-[2-(6-methyl-3-pyridyl)ethyl]-1H-pyrido[4,3-b]indole
- Molecular formula
- C24H31N3
- Molecular weight
- 361.52
Names & synonyms
20674-98-01H-Pyrido(4,3-b)indole, 2,3,4,5-tetrahydro-2-isobutyl-8-methyl-5-(2-(6-methyl-3-pyridyl)ethyl)-2,3,4,5-Tetrahydro-2-isobutyl-8-methyl-5-(2-(6-methyl-3-pyridyl)ethyl)-1H-pyrido(4,3-b)indoleDTXSID501747252,3,4,5-Tetrahydro-2-isobutyl-8-methyl-5-[2-(6-methyl-3-pyridyl)ethyl]-1H-pyrido[4,3-b]indoleRefChem:240271DTXCID30972168-methyl-2-(2-methylpropyl)-5-[2-(6-methylpyridin-3-yl)ethyl]-2,3,4,5-tetrahydro-1h-pyrido[4,3-b]indoleDB-3643182,3,4,5-TETRAHYDRO-2-ISOBUTYL-8-METHYL-5-[2-(6-METHYL-3-PYRIDYL)ETHYL ]-1H-PYRIDO[4,3-B]INDOLE1H-Pyrido[4,3-b]indole, 2,3,4,5-tetrahydro-8-methyl-2-(2-methylpropyl)-5-[2-(6-methyl-3-pyridinyl)ethyl]-
Database identifiers
- CAS
20674-98-0- PubChem CID
- 209871
- DTXSID
DTXSID50174725- Nikkaji
- J85.837D
Properties
Computed structural propertiesFilling in
- XLogP
- 4.8
- Topological polar surface area
- 21.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 478
Related reactions
0 records
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Compound notes
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