2-azidoethanimidamide

C2H5N5 — CID 150332829

IUPAC2-azidoethanimidamide
SMILES[H]/N=C(/N)CN=[N+]=[N-]
InChIInChI=1S/C2H5N5/c3-2(4)1-6-7-5/h1H2,(H3,3,4)
InChIKeyGQAUOBDRTWIZFT-UHFFFAOYSA-N
MW99.10 g/mol
LogP0.23
Rot. Bonds2

About 2-azidoethanimidamide

2-azidoethanimidamide (PubChem CID 150332829) has the molecular formula C2H5N5 and a molecular weight of 99.10 g/mol. Its IUPAC name is 2-azidoethanimidamide.

Molecular Properties

Compound Name2-azidoethanimidamide
PubChem CID150332829
Molecular FormulaC2H5N5
Molecular Weight99.10 g/mol
Exact Mass99.05
IUPAC Name2-azidoethanimidamide
SMILES[H]/N=C(/N)CN=[N+]=[N-]
InChIInChI=1S/C2H5N5/c3-2(4)1-6-7-5/h1H2,(H3,3,4)
InChIKeyGQAUOBDRTWIZFT-UHFFFAOYSA-N
XLogP0.23
TPSA98.63 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.10
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-azidoethanimidamide?
The IUPAC name of 2-azidoethanimidamide (CID 150332829) is 2-azidoethanimidamide.
What is the SMILES notation for 2-azidoethanimidamide?
The canonical SMILES for 2-azidoethanimidamide is [H]/N=C(/N)CN=[N+]=[N-].
What is the InChIKey of 2-azidoethanimidamide?
The InChIKey is GQAUOBDRTWIZFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5N5/c3-2(4)1-6-7-5/h1H2,(H3,3,4).
What are the key properties of 2-azidoethanimidamide?
2-azidoethanimidamide has a molecular weight of 99.10 g/mol, XLogP of 0.23, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azidoethanimidamide is sourced from PubChem (CID 150332829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).