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1417793-24-8 | 3-Piperidinecarboxamide, N-cyclopropyl-N-[(3-fluorophenyl)methyl]-, hydrochloride (1:1)
CAS No: 1417793-24-8 Catalog No: AG001H36 MDL No:
Product Description
Catalog Number:
AG001H36
Chemical Name:
3-Piperidinecarboxamide, N-cyclopropyl-N-[(3-fluorophenyl)methyl]-, hydrochloride (1:1)
CAS Number:
1417793-24-8
Molecular Formula:
C16H22ClFN2O
Molecular Weight:
312.8101
IUPAC Name:
N-cyclopropyl-N-[(3-fluorophenyl)methyl]piperidine-3-carboxamide;hydrochloride
InChI:
InChI=1S/C16H21FN2O.ClH/c17-14-5-1-3-12(9-14)11-19(15-6-7-15)16(20)13-4-2-8-18-10-13;/h1,3,5,9,13,15,18H,2,4,6-8,10-11H2;1H
InChI Key:
PXRZXZOZCLCCHB-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)CN(C(=O)C1CCCNC1)C1CC1.Cl
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.14g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
312.813g/mol
Monoisotopic Mass:
312.14g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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