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Home > Indoles and Oxindole > 86981-02-4
86981-02-4 | 1H-Indole, 3-[2-(3-ethyl-5,6-dihydro-1(2H)-pyridinyl)ethyl]-1-methyl-
CAS No: 86981-02-4 Catalog No: AG004KT5 MDL No:
Product Description
Catalog Number:
AG004KT5
Chemical Name:
1H-Indole, 3-[2-(3-ethyl-5,6-dihydro-1(2H)-pyridinyl)ethyl]-1-methyl-
CAS Number:
86981-02-4
Molecular Formula:
C18H24N2
Molecular Weight:
268.3966
IUPAC Name:
3-[2-(5-ethyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]-1-methylindole
InChI:
InChI=1S/C18H24N2/c1-3-15-7-6-11-20(13-15)12-10-16-14-19(2)18-9-5-4-8-17(16)18/h4-5,7-9,14H,3,6,10-13H2,1-2H3
InChI Key:
YXHMGTHXWDXYLS-UHFFFAOYSA-N
SMILES:
CCC1=CCCN(C1)CCc1cn(c2c1cccc2)C
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.194g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.404g/mol
Monoisotopic Mass:
268.194g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
8.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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