2-(1H-imidazol-2-yl)ethenylideneazanide

C5H4N3- — CID 101390804

IUPAC2-(1H-imidazol-2-yl)ethenylideneazanide
SMILES[N-]=C=Cc1ncc[nH]1
InChIInChI=1S/C5H4N3/c6-2-1-5-7-3-4-8-5/h1,3-4H,(H,7,8)/q-1
InChIKeyXJLFBAWQVVAZSK-UHFFFAOYSA-N
MW106.11 g/mol
LogP0.66
Rot. Bonds1

About 2-(1H-imidazol-2-yl)ethenylideneazanide

2-(1H-imidazol-2-yl)ethenylideneazanide (PubChem CID 101390804) has the molecular formula C5H4N3- and a molecular weight of 106.11 g/mol. Its IUPAC name is 2-(1H-imidazol-2-yl)ethenylideneazanide.

Molecular Properties

Compound Name2-(1H-imidazol-2-yl)ethenylideneazanide
PubChem CID101390804
Molecular FormulaC5H4N3-
Molecular Weight106.11 g/mol
Exact Mass106.04
IUPAC Name2-(1H-imidazol-2-yl)ethenylideneazanide
SMILES[N-]=C=Cc1ncc[nH]1
InChIInChI=1S/C5H4N3/c6-2-1-5-7-3-4-8-5/h1,3-4H,(H,7,8)/q-1
InChIKeyXJLFBAWQVVAZSK-UHFFFAOYSA-N
XLogP0.66
TPSA50.98 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.11
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 2-(1H-imidazol-2-yl)ethenylideneazanide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(Z)-3-(1H-imidazol-2-yl)prop-2-en-1-ol
CID 10909565
2-[(1E,3E)-penta-1,3-dienyl]-1H-imidazole
CID 173339835
2-[(Z)-pent-1-enyl]-1H-imidazole
CID 129140949
(Z)-3-(1H-imidazol-2-yl)prop-2-enoic acid
CID 53230707
2-ethenyl-1H-imidazole;phosphoric acid
CID 157353127
N-ethyl-1-(1H-imidazol-2-yl)methanimine
CID 160847439
2-pent-1-enyl-1H-imidazole
CID 57076372
ethane;2-[(1Z,3Z)-penta-1,3-dienyl]-1H-imidazole;hydroiodide
CID 143945095
2-[(E)-2-[10-[(E)-2-(1H-imidazol-2-yl)ethenyl]anthracen-9-yl]ethenyl]-1H-imidazole
CID 102056008
4-[(E)-2-(1H-imidazol-2-yl)ethenyl]pyridin-1-ium
CID 102403490
(E)-2-(1H-imidazol-2-yl)-1-methoxyethenolate
CID 177470134
2-[2-(4-methylphenyl)ethenyl]-1H-imidazole
CID 68963797

Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-2-yl)ethenylideneazanide?
The IUPAC name of 2-(1H-imidazol-2-yl)ethenylideneazanide (CID 101390804) is 2-(1H-imidazol-2-yl)ethenylideneazanide.
What is the SMILES notation for 2-(1H-imidazol-2-yl)ethenylideneazanide?
The canonical SMILES for 2-(1H-imidazol-2-yl)ethenylideneazanide is [N-]=C=Cc1ncc[nH]1.
What is the InChIKey of 2-(1H-imidazol-2-yl)ethenylideneazanide?
The InChIKey is XJLFBAWQVVAZSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4N3/c6-2-1-5-7-3-4-8-5/h1,3-4H,(H,7,8)/q-1.
What are the key properties of 2-(1H-imidazol-2-yl)ethenylideneazanide?
2-(1H-imidazol-2-yl)ethenylideneazanide has a molecular weight of 106.11 g/mol, XLogP of 0.66, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazol-2-yl)ethenylideneazanide is sourced from PubChem (CID 101390804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).