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71083-37-9 | 8-Ethylquinoline-3-carboxamide
CAS No: 71083-37-9 Catalog No: AG00IC51 MDL No:
Product Description
Catalog Number:
AG00IC51
Chemical Name:
8-Ethylquinoline-3-carboxamide
CAS Number:
71083-37-9
Molecular Formula:
C12H12N2O
Molecular Weight:
200.2365
IUPAC Name:
8-ethylquinoline-3-carboxamide
InChI:
InChI=1S/C12H12N2O/c1-2-8-4-3-5-9-6-10(12(13)15)7-14-11(8)9/h3-7H,2H2,1H3,(H2,13,15)
InChI Key:
NWMDUEBQHAONRR-UHFFFAOYSA-N
SMILES:
CCc1cccc2c1ncc(c2)C(=O)N
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.241g/mol
Monoisotopic Mass:
200.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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