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591251-19-3 | N-(quinolin-5-yl)prop-2-enamide
CAS No: 591251-19-3 Catalog No: AG00MBBA MDL No:MFCD12091168
Product Description
Catalog Number:
AG00MBBA
Chemical Name:
N-(quinolin-5-yl)prop-2-enamide
CAS Number:
591251-19-3
Molecular Formula:
C12H10N2O
Molecular Weight:
198.2206
MDL Number:
MFCD12091168
IUPAC Name:
N-quinolin-5-ylprop-2-enamide
InChI:
InChI=1S/C12H10N2O/c1-2-12(15)14-11-7-3-6-10-9(11)5-4-8-13-10/h2-8H,1H2,(H,14,15)
InChI Key:
RBDIPGXNTVBCTK-UHFFFAOYSA-N
SMILES:
C=CC(=O)Nc1cccc2c1cccn2
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.225g/mol
Monoisotopic Mass:
198.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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