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1104201-69-5 | N-phenyl-1,2,3,4-tetrahydroquinoline-2-carboxamide
CAS No: 1104201-69-5 Catalog No: AG01A99M MDL No:MFCD09948291
Product Description
Catalog Number:
AG01A99M
Chemical Name:
N-phenyl-1,2,3,4-tetrahydroquinoline-2-carboxamide
CAS Number:
1104201-69-5
Molecular Formula:
C16H16N2O
Molecular Weight:
252.3110
MDL Number:
MFCD09948291
IUPAC Name:
N-phenyl-1,2,3,4-tetrahydroquinoline-2-carboxamide
InChI:
InChI=1S/C16H16N2O/c19-16(17-13-7-2-1-3-8-13)15-11-10-12-6-4-5-9-14(12)18-15/h1-9,15,18H,10-11H2,(H,17,19)
InChI Key:
CMJYOZDBTKNGBU-UHFFFAOYSA-N
SMILES:
O=C(C1CCc2c(N1)cccc2)Nc1ccccc1
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.126g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
252.317g/mol
Monoisotopic Mass:
252.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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