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88630-39-1 | 1(2H)-Quinolinecarboxamide, N-butyl-3,4-dihydro-
CAS No: 88630-39-1 Catalog No: AG0049V1 MDL No:MFCD06162650
Product Description
Catalog Number:
AG0049V1
Chemical Name:
1(2H)-Quinolinecarboxamide, N-butyl-3,4-dihydro-
CAS Number:
88630-39-1
Molecular Formula:
C14H20N2O
Molecular Weight:
232.3214
MDL Number:
MFCD06162650
IUPAC Name:
N-butyl-3,4-dihydro-2H-quinoline-1-carboxamide
InChI:
InChI=1S/C14H20N2O/c1-2-3-10-15-14(17)16-11-6-8-12-7-4-5-9-13(12)16/h4-5,7,9H,2-3,6,8,10-11H2,1H3,(H,15,17)
InChI Key:
UBRIGXFVQFIOKF-UHFFFAOYSA-N
SMILES:
CCCCNC(=O)N1CCCc2c1cccc2
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.158g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.327g/mol
Monoisotopic Mass:
232.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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