Molecular Identity
Imidazole
1H-imidazole
PubChem CID: 795
1H-imidazole is an imidazole tautomer which has the migrating hydrogen at position 1. It is a conjugate base of an imidazolium cation. It is a conjugate acid of an imidazolide. It is a tautomer of a 4H-imidazole.
2D Structure
Properties
C3H4N2
Molecular Formula
68.08
Molecular Weight
g/mol
68.0374
Exact Mass
Da
-0.1
XLogP
Drug-like (Lipinski: < 5)
28.7
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
1
H-Bond Acceptors
28
Complexity
SMILES
Canonical SMILES
SMILES: C1=CN=CN1Isomeric SMILES
SMILES: C1=CN=CN1Synonyms(20)
imidazole1H-Imidazole288-32-4GlyoxalineImidazolIminazoleMiazole1,3-DiazoleImutexGlyoxalin1,3-Diaza-2,4-cyclopentadienePyrro(b)monazoleGlioksalFormamidine, N,N'-vinylene-Pyrro[b]monazole
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Imidazole
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