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182563-03-7

182563-03-7 | Acetamide, N-[3-(1-methyl-4-piperidinyl)-1H-indol-5-yl]-

CAS No: 182563-03-7 Catalog No: AG0023Z6 MDL No:

Product Description

Catalog Number:
AG0023Z6
Chemical Name:
Acetamide, N-[3-(1-methyl-4-piperidinyl)-1H-indol-5-yl]-
CAS Number:
182563-03-7
Molecular Formula:
C16H21N3O
Molecular Weight:
271.3574
IUPAC Name:
N-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]acetamide
InChI:
InChI=1S/C16H21N3O/c1-11(20)18-13-3-4-16-14(9-13)15(10-17-16)12-5-7-19(2)8-6-12/h3-4,9-10,12,17H,5-8H2,1-2H3,(H,18,20)
InChI Key:
DXVFIKXMKWRGPL-UHFFFAOYSA-N
SMILES:
CN1CCC(CC1)c1c[nH]c2c1cc(cc2)NC(=O)C

Properties

Complexity:
352  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.168g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
271.364g/mol
Monoisotopic Mass:
271.168g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Literature

Title Journal
Novel potent 5-HT(1F) receptor agonists: structure-activity studies of a series of substituted N-[3-(1-methyl-4-piperidinyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]amides. Journal of medicinal chemistry 20030703

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