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1353997-19-9 | N-[(S)-1-(2-Amino-acetyl)-pyrrolidin-3-yl]-acetamide
CAS No: 1353997-19-9 Catalog No: AG01F8IH MDL No:
Product Description
Catalog Number:
AG01F8IH
Chemical Name:
N-[(S)-1-(2-Amino-acetyl)-pyrrolidin-3-yl]-acetamide
CAS Number:
1353997-19-9
Molecular Formula:
C8H15N3O2
Molecular Weight:
185.2236
IUPAC Name:
N-[(3S)-1-(2-aminoacetyl)pyrrolidin-3-yl]acetamide
InChI:
InChI=1S/C8H15N3O2/c1-6(12)10-7-2-3-11(5-7)8(13)4-9/h7H,2-5,9H2,1H3,(H,10,12)/t7-/m0/s1
InChI Key:
PWVUBVUJKVSPBT-ZETCQYMHSA-N
SMILES:
NCC(=O)N1CC[C@@H](C1)NC(=O)C
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
185.116g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
185.227g/mol
Monoisotopic Mass:
185.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.7
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