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Home > Indoles and Oxindole > 82980-06-1
82980-06-1 | 1H-Indole, 3-[2-(3-ethyl-5,6-dihydro-1(2H)-pyridinyl)ethyl]-
CAS No: 82980-06-1 Catalog No: AG0053TE MDL No:
Product Description
Catalog Number:
AG0053TE
Chemical Name:
1H-Indole, 3-[2-(3-ethyl-5,6-dihydro-1(2H)-pyridinyl)ethyl]-
CAS Number:
82980-06-1
Molecular Formula:
C17H22N2
Molecular Weight:
254.3700
IUPAC Name:
3-[2-(5-ethyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]-1H-indole
InChI:
InChI=1S/C17H22N2/c1-2-14-6-5-10-19(13-14)11-9-15-12-18-17-8-4-3-7-16(15)17/h3-4,6-8,12,18H,2,5,9-11,13H2,1H3
InChI Key:
OWIJIWOPJQRUOW-UHFFFAOYSA-N
SMILES:
CCC1=CCCN(C1)CCc1c[nH]c2c1cccc2
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.178g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.377g/mol
Monoisotopic Mass:
254.178g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
19A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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