N-[2-(2-benzimidazolylmethylamino)ethyl]-N'-cyano-N"-methylguanidine

HCID 54536364
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Basic information

Standard SMILES
CN=C(NC#N)NCCNCc1nc2ccccc2[nH]1
InChIKey
ZABHEMQMDHVYIQ-UHFFFAOYSA-N
Molecular formula
C13H17N7
Average molar mass
271.32 g/mol

Names & identifiers

Preferred name
N-[2-(2-benzimidazolylmethylamino)ethyl]-N'-cyano-N"-methylguanidine
IUPAC
1-[2-(1H-benzimidazol-2-ylmethylamino)ethyl]-3-cyano-2-methylguanidine

Names & synonyms

SCHEMBL11360400SCHEMBL11360405SCHEMBL11360407ZABHEMQMDHVYIQ-UHFFFAOYSA-NN-[2-(2-benzimidazolylmethylamino)ethyl]-N'-cyano-N"-methylguanidine

Database identifiers

PubChem CID
54536364

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
101 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
20

Related reactions

9 records
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Compound notes

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