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Home > Indoles and Oxindole > 6116-47-8
6116-47-8 | 2,3-dimethyl-1H-indole-5-carboxamide
CAS No: 6116-47-8 Catalog No: AG019Y7I MDL No:MFCD03926451
Product Description
Catalog Number:
AG019Y7I
Chemical Name:
2,3-dimethyl-1H-indole-5-carboxamide
CAS Number:
6116-47-8
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
MDL Number:
MFCD03926451
IUPAC Name:
2,3-dimethyl-1H-indole-5-carboxamide
InChI:
InChI=1S/C11H12N2O/c1-6-7(2)13-10-4-3-8(11(12)14)5-9(6)10/h3-5,13H,1-2H3,(H2,12,14)
InChI Key:
MGDDNBUVXGOULU-UHFFFAOYSA-N
SMILES:
NC(=O)c1ccc2c(c1)c(C)c([nH]2)C
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
188.23g/mol
Monoisotopic Mass:
188.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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