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76049-36-0 | Butanamide, N-[2-(1H-indol-3-yl)ethyl]-
CAS No: 76049-36-0 Catalog No: AG005GGP MDL No:MFCD08554231
Product Description
Catalog Number:
AG005GGP
Chemical Name:
Butanamide, N-[2-(1H-indol-3-yl)ethyl]-
CAS Number:
76049-36-0
Molecular Formula:
C14H18N2O
Molecular Weight:
230.3055
MDL Number:
MFCD08554231
IUPAC Name:
N-[2-(1H-indol-3-yl)ethyl]butanamide
InChI:
InChI=1S/C14H18N2O/c1-2-5-14(17)15-9-8-11-10-16-13-7-4-3-6-12(11)13/h3-4,6-7,10,16H,2,5,8-9H2,1H3,(H,15,17)
InChI Key:
CONGMAIJMUNLHQ-UHFFFAOYSA-N
SMILES:
CCCC(=O)NCCc1c[nH]c2c1cccc2
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.142g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
230.311g/mol
Monoisotopic Mass:
230.142g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
44.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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