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29745-42-4 | 3-Pyridinecarboxamide, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-
CAS No: 29745-42-4 Catalog No: AG002ZA6 MDL No:
Product Description
Catalog Number:
AG002ZA6
Chemical Name:
3-Pyridinecarboxamide, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-
CAS Number:
29745-42-4
Molecular Formula:
C17H17N3O2
Molecular Weight:
295.3358
IUPAC Name:
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]pyridine-3-carboxamide
InChI:
InChI=1S/C17H17N3O2/c1-22-14-4-5-16-15(9-14)12(11-20-16)6-8-19-17(21)13-3-2-7-18-10-13/h2-5,7,9-11,20H,6,8H2,1H3,(H,19,21)
InChI Key:
JAXFNBSXSXDREO-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(CCNC(=O)c1cccnc1)c[nH]2
Properties
Complexity:
377
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.132g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
295.342g/mol
Monoisotopic Mass:
295.132g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
67A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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