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1261232-67-0 | Ethanone, 2-(4-amino-1-piperidinyl)-1-(2-thienyl)-, hydrochloride (1:1)
CAS No: 1261232-67-0 Catalog No: AG000RON MDL No:
Product Description
Catalog Number:
AG000RON
Chemical Name:
Ethanone, 2-(4-amino-1-piperidinyl)-1-(2-thienyl)-, hydrochloride (1:1)
CAS Number:
1261232-67-0
Molecular Formula:
C11H17ClN2OS
Molecular Weight:
260.7835
IUPAC Name:
2-(4-aminopiperidin-1-yl)-1-thiophen-2-ylethanone;hydrochloride
InChI:
InChI=1S/C11H16N2OS.ClH/c12-9-3-5-13(6-4-9)8-10(14)11-2-1-7-15-11;/h1-2,7,9H,3-6,8,12H2;1H
InChI Key:
BHZYWRKTFARCDG-UHFFFAOYSA-N
SMILES:
NC1CCN(CC1)CC(=O)c1cccs1.Cl
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.075g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
260.78g/mol
Monoisotopic Mass:
260.075g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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