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Home > Indoles and Oxindole > 6245-91-6
6245-91-6 | 4-(1H-indol-3-yl)butanamide
CAS No: 6245-91-6 Catalog No: AG01BG8S MDL No:MFCD00458388
Product Description
Catalog Number:
AG01BG8S
Chemical Name:
4-(1H-indol-3-yl)butanamide
CAS Number:
6245-91-6
Molecular Formula:
C12H14N2O
Molecular Weight:
202.2524
MDL Number:
MFCD00458388
IUPAC Name:
4-(1H-indol-3-yl)butanamide
InChI:
InChI=1S/C12H14N2O/c13-12(15)7-3-4-9-8-14-11-6-2-1-5-10(9)11/h1-2,5-6,8,14H,3-4,7H2,(H2,13,15)
InChI Key:
OIIPKTMVZHTWNH-UHFFFAOYSA-N
SMILES:
NC(=O)CCCc1c[nH]c2c1cccc2
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
202.257g/mol
Monoisotopic Mass:
202.111g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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