Home Other Building Blocks N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-2,2,2-trifluoroacetamide

N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-2,2,2-trifluoroacetamide

CAS No.:
180910-65-0
Catalog Number:
AG01C2ZG
Molecular Formula:
C12H13F3N2O
Molecular Weight:
258.2396
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Product Description
Catalog Number:
AG01C2ZG
Chemical Name:
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-2,2,2-trifluoroacetamide
CAS Number:
180910-65-0
Molecular Formula:
C12H13F3N2O
Molecular Weight:
258.2396
MDL Number:
MFCD30535584
IUPAC Name:
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-2,2,2-trifluoroacetamide
InChI:
InChI=1S/C12H13F3N2O/c13-12(14,15)11(18)16-6-5-8-7-17-10-4-2-1-3-9(8)10/h1-4,8,17H,5-7H2,(H,16,18)
InChI Key:
VKNXSCZLVYUIRB-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)NCCC1CNc2c1cccc2
Properties
Complexity:
306  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.098g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
258.244g/mol
Monoisotopic Mass:
258.098g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties