pyrrol-1-ylhydrazine

C4H7N3 — CID 68554829

IUPACpyrrol-1-ylhydrazine
SMILESNNn1cccc1
InChIInChI=1S/C4H7N3/c5-6-7-3-1-2-4-7/h1-4,6H,5H2
InChIKeyOLFUUGSPQDWSDT-UHFFFAOYSA-N
MW97.12 g/mol
LogP-0.09
Rot. Bonds1

About pyrrol-1-ylhydrazine

pyrrol-1-ylhydrazine (PubChem CID 68554829) has the molecular formula C4H7N3 and a molecular weight of 97.12 g/mol. Its IUPAC name is pyrrol-1-ylhydrazine.

Molecular Properties

Compound Namepyrrol-1-ylhydrazine
PubChem CID68554829
Molecular FormulaC4H7N3
Molecular Weight97.12 g/mol
Exact Mass97.06
IUPAC Namepyrrol-1-ylhydrazine
SMILESNNn1cccc1
InChIInChI=1S/C4H7N3/c5-6-7-3-1-2-4-7/h1-4,6H,5H2
InChIKeyOLFUUGSPQDWSDT-UHFFFAOYSA-N
XLogP-0.09
TPSA42.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.12
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 pyrrol-1-ylhydrazine?
The IUPAC name of pyrrol-1-ylhydrazine (CID 68554829) is pyrrol-1-ylhydrazine.
What is the SMILES notation for pyrrol-1-ylhydrazine?
The canonical SMILES for pyrrol-1-ylhydrazine is NNn1cccc1.
What is the InChIKey of pyrrol-1-ylhydrazine?
The InChIKey is OLFUUGSPQDWSDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3/c5-6-7-3-1-2-4-7/h1-4,6H,5H2.
What are the key properties of pyrrol-1-ylhydrazine?
pyrrol-1-ylhydrazine has a molecular weight of 97.12 g/mol, XLogP of -0.09, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyrrol-1-ylhydrazine is sourced from PubChem (CID 68554829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).