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Home > Imidazoles > 947013-81-2
947013-81-2 | 1-methyl-2-(3-piperidinyl)-1H-benzimidazole
CAS No: 947013-81-2 Catalog No: AG00J368 MDL No:MFCD11048662
Product Description
Catalog Number:
AG00J368
Chemical Name:
1-methyl-2-(3-piperidinyl)-1H-benzimidazole
CAS Number:
947013-81-2
Molecular Formula:
C13H17N3
Molecular Weight:
215.2942
MDL Number:
MFCD11048662
IUPAC Name:
1-methyl-2-piperidin-3-ylbenzimidazole
InChI:
InChI=1S/C13H17N3/c1-16-12-7-3-2-6-11(12)15-13(16)10-5-4-8-14-9-10/h2-3,6-7,10,14H,4-5,8-9H2,1H3
InChI Key:
FFKLONUZDYIOEA-UHFFFAOYSA-N
SMILES:
Cn1c(nc2c1cccc2)C1CCCNC1
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.142g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.3g/mol
Monoisotopic Mass:
215.142g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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