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1394040-55-1 | N-(1,2,3,4-tetrahydroquinolin-5-yl)butanamide hydrochloride
CAS No: 1394040-55-1 Catalog No: AG01A0BA MDL No:MFCD22378676
Product Description
Catalog Number:
AG01A0BA
Chemical Name:
N-(1,2,3,4-tetrahydroquinolin-5-yl)butanamide hydrochloride
CAS Number:
1394040-55-1
Molecular Formula:
C13H19ClN2O
Molecular Weight:
254.7558
MDL Number:
MFCD22378676
IUPAC Name:
N-(1,2,3,4-tetrahydroquinolin-5-yl)butanamide;hydrochloride
InChI:
InChI=1S/C13H18N2O.ClH/c1-2-5-13(16)15-12-8-3-7-11-10(12)6-4-9-14-11;/h3,7-8,14H,2,4-6,9H2,1H3,(H,15,16);1H
InChI Key:
PNOMPVMKZAMAAT-UHFFFAOYSA-N
SMILES:
CCCC(=O)Nc1cccc2c1CCCN2.Cl
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.119g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
254.758g/mol
Monoisotopic Mass:
254.119g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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