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1353985-54-2 | N-[1-(2-Amino-ethyl)-piperidin-3-yl]-acetamide
CAS No: 1353985-54-2 Catalog No: AG01FA2Q MDL No:
Product Description
Catalog Number:
AG01FA2Q
Chemical Name:
N-[1-(2-Amino-ethyl)-piperidin-3-yl]-acetamide
CAS Number:
1353985-54-2
Molecular Formula:
C9H19N3O
Molecular Weight:
185.2667
IUPAC Name:
N-[1-(2-aminoethyl)piperidin-3-yl]acetamide
InChI:
InChI=1S/C9H19N3O/c1-8(13)11-9-3-2-5-12(7-9)6-4-10/h9H,2-7,10H2,1H3,(H,11,13)
InChI Key:
YYCCNUIYJJPHND-UHFFFAOYSA-N
SMILES:
NCCN1CCCC(C1)NC(=O)C
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.153g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
185.271g/mol
Monoisotopic Mass:
185.153g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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