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6-methyl-1-(4-methylphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline

6-methyl-1-(4-methylphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline - CAS 529476-77-5

Catalog:	BB052377
Product Name:	6-methyl-1-(4-methylphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline
CAS:	529476-77-5
Synonyms:	6-Methyl-1-(4-methylphenyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

Technical Data

Computed Properties

IUPAC Name:	6-methyl-1-(4-methylphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Molecular Weight:	276.37
Molecular Formula:	C19H20N2
Canonical SMILES:	CC1=CC=C(C=C1)C2C3=C(CCN2)C4=C(N3)C=CC(=C4)C
InChI:	InChI=1S/C19H20N2/c1-12-3-6-14(7-4-12)18-19-15(9-10-20-18)16-11-13(2)5-8-17(16)21-19/h3-8,11,18,20-21H,9-10H2,1-2H3
InChI Key:	MKXIPSOZLXGOFM-UHFFFAOYSA-N

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Related Functional Groups

Arenes

[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1106917-71-8]
[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
[81574-05-2]
N-Benzyl-1-methyl-1H-pyrazol-3-amine
[1429417-80-0]
N-Benzyl-1-methyl-4-nitro-1H-pyrazol-3-amine
[30879-49-3]
2'-Nitro-5'-hydroxyacetophenone
[75907-83-4]
2-Fluoro-N-hydroxy-benzamidine

Halides

[1431970-24-9]
2,2-Difluoro-N-[1-(1-methylpyrazol-4-yl)ethyl]ethanamine hydrochloride
[1936054-65-7]
2,4-Dichloro-3,6-dimethylquinoline
[4185-62-0]
2-Bromo-1-nitronaphthalene
[393841-81-1]
2'-Bromo-2,7-DI-tert-butyl-9,9'-spirobi[fluorene]
[98447-30-4]
2-Bromo-4-methoxynitrobenzene
[267242-99-9]
2-Chloro-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine

Indoles

[1884330-89-5]
1-Methyl-1H-indole-5-D
[2642-37-7]
Indoxyl sulfate potassium salt
[119910-45-1]
2-bromo-1H-indole-3-carbaldehyde
[1375064-59-7]
Ethyl 3-Bromoindole-1-carboxylate
[467458-46-4]
Ethyl 3-formyl-1H-indole-5-carboxylate
[927181-98-4]
Ethyl 3-formyl-1H-indole-7-carboxylate

Complexity:	361
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	276.162648646
Formal Charge:	0
Heavy Atom Count:	21
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	276.162648646
Rotatable Bond Count:	1
Topological Polar Surface Area:	27.8
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	3.9