[amino(hydrazinyl)methylidene]-butylazanium

C5H15N4+ — CID 160652330

IUPAC[amino(hydrazinyl)methylidene]-butylazanium
SMILESCCCC/[NH+]=C(\N)NN
InChIInChI=1S/C5H14N4/c1-2-3-4-8-5(6)9-7/h2-4,7H2,1H3,(H3,6,8,9)/p+1
InChIKeyRKOXFDRJCSHQRU-UHFFFAOYSA-O
MW131.20 g/mol
LogP-2.35
Rot. Bonds3

About [amino(hydrazinyl)methylidene]-butylazanium

[amino(hydrazinyl)methylidene]-butylazanium (PubChem CID 160652330) has the molecular formula C5H15N4+ and a molecular weight of 131.20 g/mol. Its IUPAC name is [amino(hydrazinyl)methylidene]-butylazanium.

Molecular Properties

Compound Name[amino(hydrazinyl)methylidene]-butylazanium
PubChem CID160652330
Molecular FormulaC5H15N4+
Molecular Weight131.20 g/mol
Exact Mass131.13
IUPAC Name[amino(hydrazinyl)methylidene]-butylazanium
SMILESCCCC/[NH+]=C(\N)NN
InChIInChI=1S/C5H14N4/c1-2-3-4-8-5(6)9-7/h2-4,7H2,1H3,(H3,6,8,9)/p+1
InChIKeyRKOXFDRJCSHQRU-UHFFFAOYSA-O
XLogP-2.35
TPSA78.04 Ų
H-Bond Donors4
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.20
LogP ≤ 5-2.35
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', '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 [amino(hydrazinyl)methylidene]-butylazanium?
The IUPAC name of [amino(hydrazinyl)methylidene]-butylazanium (CID 160652330) is [amino(hydrazinyl)methylidene]-butylazanium.
What is the SMILES notation for [amino(hydrazinyl)methylidene]-butylazanium?
The canonical SMILES for [amino(hydrazinyl)methylidene]-butylazanium is CCCC/[NH+]=C(\N)NN.
What is the InChIKey of [amino(hydrazinyl)methylidene]-butylazanium?
The InChIKey is RKOXFDRJCSHQRU-UHFFFAOYSA-O. The full InChI is InChI=1S/C5H14N4/c1-2-3-4-8-5(6)9-7/h2-4,7H2,1H3,(H3,6,8,9)/p+1.
What are the key properties of [amino(hydrazinyl)methylidene]-butylazanium?
[amino(hydrazinyl)methylidene]-butylazanium has a molecular weight of 131.20 g/mol, XLogP of -2.35, 3 rotatable bonds, 4 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [amino(hydrazinyl)methylidene]-butylazanium is sourced from PubChem (CID 160652330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).