[5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine

C11H12N6 — CID 116884165

IUPAC[5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine
SMILESCc1nc2ccc(-c3cnc(NN)[nH]3)cc2[nH]1
InChIInChI=1S/C11H12N6/c1-6-14-8-3-2-7(4-9(8)15-6)10-5-13-11(16-10)17-12/h2-5H,12H2,1H3,(H,14,15)(H2,13,16,17)
InChIKeyDFNDLSKLVJGBMT-UHFFFAOYSA-N
MW228.26 g/mol
LogP1.55
Rot. Bonds2

About [5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine

[5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine (PubChem CID 116884165) has the molecular formula C11H12N6 and a molecular weight of 228.26 g/mol. Its IUPAC name is [5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine
PubChem CID116884165
Molecular FormulaC11H12N6
Molecular Weight228.26 g/mol
Exact Mass228.11
IUPAC Name[5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine
SMILESCc1nc2ccc(-c3cnc(NN)[nH]3)cc2[nH]1
InChIInChI=1S/C11H12N6/c1-6-14-8-3-2-7(4-9(8)15-6)10-5-13-11(16-10)17-12/h2-5H,12H2,1H3,(H,14,15)(H2,13,16,17)
InChIKeyDFNDLSKLVJGBMT-UHFFFAOYSA-N
XLogP1.55
TPSA95.41 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.26
LogP ≤ 51.55
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-amino-1-[5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]ethanol
CID 116881704
2-[5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]acetic acid
CID 116878629
2-methyl-6-(4-phenylphenyl)-1H-benzimidazole
CID 175938016
[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-imidazol-2-yl]hydrazine
CID 116884079
N-methyl-1-[4-(2-methyl-3H-benzimidazol-5-yl)pyrimidin-2-yl]methanamine
CID 116897507
3-(2-methyl-3H-benzimidazol-5-yl)-7-(2-methyl-1H-imidazol-5-yl)chromen-4-one
CID 123582296
2-methyl-6-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole
CID 116856632
[5-(4-ethylsulfanylphenyl)-1H-imidazol-2-yl]hydrazine
CID 116884155
[5-[4-(2-methylpropyl)phenyl]-1H-imidazol-2-yl]hydrazine
CID 116884087
N-methyl-2-[4-(2-methyl-3H-benzimidazol-5-yl)pyrimidin-2-yl]ethanamine
CID 116897788
hydrazinyl-(2-methyl-3H-benzimidazol-5-yl)methanamine
CID 116947494
N-(hydrazinylmethyl)-1-(2-methyl-3H-benzimidazol-5-yl)methanamine
CID 115260836

Frequently Asked Questions

What is the IUPAC name of [5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine?
The IUPAC name of [5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine (CID 116884165) is [5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine.
What is the SMILES notation for [5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine?
The canonical SMILES for [5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine is Cc1nc2ccc(-c3cnc(NN)[nH]3)cc2[nH]1.
What is the InChIKey of [5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine?
The InChIKey is DFNDLSKLVJGBMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N6/c1-6-14-8-3-2-7(4-9(8)15-6)10-5-13-11(16-10)17-12/h2-5H,12H2,1H3,(H,14,15)(H2,13,16,17).
What are the key properties of [5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine?
[5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine has a molecular weight of 228.26 g/mol, XLogP of 1.55, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-methyl-3H-benzimidazol-5-yl)-1H-imidazol-2-yl]hydrazine is sourced from PubChem (CID 116884165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).