4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide

C3H9BrN4 — CID 74764078

IUPAC4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide
SMILESNNC1=NCCN1.[Br-].[H+]
InChIInChI=1S/C3H8N4.BrH/c4-7-3-5-1-2-6-3;/h1-2,4H2,(H2,5,6,7);1H
InChIKeyHIJRJVVSABWXKG-UHFFFAOYSA-N
MW181.04 g/mol
LogP-4.47
Rot. Bonds

About 4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide

4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide (PubChem CID 74764078) has the molecular formula C3H9BrN4 and a molecular weight of 181.04 g/mol. Its IUPAC name is 4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide.

Molecular Properties

Compound Name4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide
PubChem CID74764078
Molecular FormulaC3H9BrN4
Molecular Weight181.04 g/mol
Exact Mass180.00
IUPAC Name4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide
SMILESNNC1=NCCN1.[Br-].[H+]
InChIInChI=1S/C3H8N4.BrH/c4-7-3-5-1-2-6-3;/h1-2,4H2,(H2,5,6,7);1H
InChIKeyHIJRJVVSABWXKG-UHFFFAOYSA-N
XLogP-4.47
TPSA62.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.04
LogP ≤ 5-4.47
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of 4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide?
The IUPAC name of 4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide (CID 74764078) is 4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide.
What is the SMILES notation for 4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide?
The canonical SMILES for 4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide is NNC1=NCCN1.[Br-].[H+].
What is the InChIKey of 4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide?
The InChIKey is HIJRJVVSABWXKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N4.BrH/c4-7-3-5-1-2-6-3;/h1-2,4H2,(H2,5,6,7);1H.
What are the key properties of 4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide?
4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide has a molecular weight of 181.04 g/mol, XLogP of -4.47, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dihydro-1H-imidazol-2-ylhydrazine;hydron;bromide is sourced from PubChem (CID 74764078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).