2-hydrazinylbenzimidazol-1-amine

C7H9N5 — CID 15134223

IUPAC2-hydrazinylbenzimidazol-1-amine
SMILESNNc1nc2ccccc2n1N
InChIInChI=1S/C7H9N5/c8-11-7-10-5-3-1-2-4-6(5)12(7)9/h1-4H,8-9H2,(H,10,11)
InChIKeyTUMLDHMRIOZXQR-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.04
Rot. Bonds1

About 2-hydrazinylbenzimidazol-1-amine

2-hydrazinylbenzimidazol-1-amine (PubChem CID 15134223) has the molecular formula C7H9N5 and a molecular weight of 163.18 g/mol. Its IUPAC name is 2-hydrazinylbenzimidazol-1-amine.

Molecular Properties

Compound Name2-hydrazinylbenzimidazol-1-amine
PubChem CID15134223
Molecular FormulaC7H9N5
Molecular Weight163.18 g/mol
Exact Mass163.09
IUPAC Name2-hydrazinylbenzimidazol-1-amine
SMILESNNc1nc2ccccc2n1N
InChIInChI=1S/C7H9N5/c8-11-7-10-5-3-1-2-4-6(5)12(7)9/h1-4H,8-9H2,(H,10,11)
InChIKeyTUMLDHMRIOZXQR-UHFFFAOYSA-N
XLogP0.04
TPSA81.89 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-hydrazinylbenzimidazol-1-amine?
The IUPAC name of 2-hydrazinylbenzimidazol-1-amine (CID 15134223) is 2-hydrazinylbenzimidazol-1-amine.
What is the SMILES notation for 2-hydrazinylbenzimidazol-1-amine?
The canonical SMILES for 2-hydrazinylbenzimidazol-1-amine is NNc1nc2ccccc2n1N.
What is the InChIKey of 2-hydrazinylbenzimidazol-1-amine?
The InChIKey is TUMLDHMRIOZXQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N5/c8-11-7-10-5-3-1-2-4-6(5)12(7)9/h1-4H,8-9H2,(H,10,11).
What are the key properties of 2-hydrazinylbenzimidazol-1-amine?
2-hydrazinylbenzimidazol-1-amine has a molecular weight of 163.18 g/mol, XLogP of 0.04, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinylbenzimidazol-1-amine is sourced from PubChem (CID 15134223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).