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114649-92-2 | 1-Piperazinecarboxamide, N,N,3-trimethyl-
CAS No: 114649-92-2 Catalog No: AG000EY1 MDL No:
Product Description
Catalog Number:
AG000EY1
Chemical Name:
1-Piperazinecarboxamide, N,N,3-trimethyl-
CAS Number:
114649-92-2
Molecular Formula:
C8H17N3O
Molecular Weight:
171.2401
IUPAC Name:
N,N,3-trimethylpiperazine-1-carboxamide
InChI:
InChI=1S/C8H17N3O/c1-7-6-11(5-4-9-7)8(12)10(2)3/h7,9H,4-6H2,1-3H3
InChI Key:
AYOUISFJHNPBPO-UHFFFAOYSA-N
SMILES:
CC1NCCN(C1)C(=O)N(C)C
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.137g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.244g/mol
Monoisotopic Mass:
171.137g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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