Home Aminos 2-[(5-amino-1H-1,3-benzodiazol-2-yl)(methyl)amino]-N-methylacetamide

2-[(5-amino-1H-1,3-benzodiazol-2-yl)(methyl)amino]-N-methylacetamide

CAS No.:
1506350-69-1
Catalog Number:
AG01BDOH
Molecular Formula:
C11H15N5O
Molecular Weight:
233.2697
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Product Description
Catalog Number:
AG01BDOH
Chemical Name:
2-[(5-amino-1H-1,3-benzodiazol-2-yl)(methyl)amino]-N-methylacetamide
CAS Number:
1506350-69-1
Molecular Formula:
C11H15N5O
Molecular Weight:
233.2697
MDL Number:
MFCD22920691
IUPAC Name:
2-[(6-amino-1H-benzimidazol-2-yl)-methylamino]-N-methylacetamide
InChI:
InChI=1S/C11H15N5O/c1-13-10(17)6-16(2)11-14-8-4-3-7(12)5-9(8)15-11/h3-5H,6,12H2,1-2H3,(H,13,17)(H,14,15)
InChI Key:
YREYLLLQLLXVKS-UHFFFAOYSA-N
SMILES:
CNC(=O)CN(c1nc2c([nH]1)ccc(c2)N)C
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.128g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
233.275g/mol
Monoisotopic Mass:
233.128g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties