(Z)-3-azidoprop-2-enamide

C3H4N4O — CID 155920099

IUPAC(Z)-3-azidoprop-2-enamide
SMILES[N-]=[N+]=N/C=C\C(N)=O
InChIInChI=1S/C3H4N4O/c4-3(8)1-2-6-7-5/h1-2H,(H2,4,8)/b2-1-
InChIKeyACXZOSXEISPMRY-UPHRSURJSA-N
MW112.09 g/mol
LogP0.30
Rot. Bonds2

About (Z)-3-azidoprop-2-enamide

(Z)-3-azidoprop-2-enamide (PubChem CID 155920099) has the molecular formula C3H4N4O and a molecular weight of 112.09 g/mol. Its IUPAC name is (Z)-3-azidoprop-2-enamide.

Molecular Properties

Compound Name(Z)-3-azidoprop-2-enamide
PubChem CID155920099
Molecular FormulaC3H4N4O
Molecular Weight112.09 g/mol
Exact Mass112.04
IUPAC Name(Z)-3-azidoprop-2-enamide
SMILES[N-]=[N+]=N/C=C\C(N)=O
InChIInChI=1S/C3H4N4O/c4-3(8)1-2-6-7-5/h1-2H,(H2,4,8)/b2-1-
InChIKeyACXZOSXEISPMRY-UPHRSURJSA-N
XLogP0.30
TPSA91.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.09
LogP ≤ 50.30
H-Bond Donors ≤ 51
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': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-azidoprop-2-enamide?
The IUPAC name of (Z)-3-azidoprop-2-enamide (CID 155920099) is (Z)-3-azidoprop-2-enamide.
What is the SMILES notation for (Z)-3-azidoprop-2-enamide?
The canonical SMILES for (Z)-3-azidoprop-2-enamide is [N-]=[N+]=N/C=C\C(N)=O.
What is the InChIKey of (Z)-3-azidoprop-2-enamide?
The InChIKey is ACXZOSXEISPMRY-UPHRSURJSA-N. The full InChI is InChI=1S/C3H4N4O/c4-3(8)1-2-6-7-5/h1-2H,(H2,4,8)/b2-1-.
What are the key properties of (Z)-3-azidoprop-2-enamide?
(Z)-3-azidoprop-2-enamide has a molecular weight of 112.09 g/mol, XLogP of 0.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-azidoprop-2-enamide is sourced from PubChem (CID 155920099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).