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N-(1-Phenylethyl)-3H-benzo[d]imidazol-5-amine

HCID 67446293
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CC(Nc1ccc2nc[nH]c2c1)c1ccccc1
InChIKey
DKXWMISXMXRPMR-UHFFFAOYSA-N
Molecular formula
C15H15N3
Average molar mass
237.3 g/mol

Names & identifiers

Preferred name
N-(1-Phenylethyl)-3H-benzo[d]imidazol-5-amine
IUPAC
N-(1-phenylethyl)-3H-benzimidazol-5-amine

Names & synonyms

SCHEMBL2544250DKXWMISXMXRPMR-UHFFFAOYSA-NN-(1-Phenylethyl)-3H-benzo[d]imidazol-5-amine

Database identifiers

PubChem CID
67446293

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
40.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
18
Formal charge
0
Complexity
262

Related reactions

2 records
New reaction record
HRID 45929 reaction equation
HRID 45929As productuspto-grants-2013_09
HRID 1144894 reaction equation
HRID 1144894As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

Compound notes

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