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832102-60-0 | 1H-Benzimidazol-5-amine, 2-(1-piperidinyl)-
CAS No: 832102-60-0 Catalog No: AG004ZDB MDL No:
Product Description
Catalog Number:
AG004ZDB
Chemical Name:
1H-Benzimidazol-5-amine, 2-(1-piperidinyl)-
CAS Number:
832102-60-0
Molecular Formula:
C12H16N4
Molecular Weight:
216.2822
IUPAC Name:
2-piperidin-1-yl-3H-benzimidazol-5-amine
InChI:
InChI=1S/C12H16N4/c13-9-4-5-10-11(8-9)15-12(14-10)16-6-2-1-3-7-16/h4-5,8H,1-3,6-7,13H2,(H,14,15)
InChI Key:
NKAPXWIFLZNFAE-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)nc([nH]2)N1CCCCC1
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.137g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
216.288g/mol
Monoisotopic Mass:
216.137g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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