5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole

C10H8N6 — CID 123654814

IUPAC5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole
SMILESc1c[nH]c(-c2ccc(-c3nn[nH]n3)cc2)n1
InChIInChI=1S/C10H8N6/c1-3-8(10-13-15-16-14-10)4-2-7(1)9-11-5-6-12-9/h1-6H,(H,11,12)(H,13,14,15,16)
InChIKeyZOJXHSDXUDSHOM-UHFFFAOYSA-N
MW212.22 g/mol
LogP1.26
Rot. Bonds2

About 5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole

5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole (PubChem CID 123654814) has the molecular formula C10H8N6 and a molecular weight of 212.22 g/mol. Its IUPAC name is 5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole.

Molecular Properties

Compound Name5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole
PubChem CID123654814
Molecular FormulaC10H8N6
Molecular Weight212.22 g/mol
Exact Mass212.08
IUPAC Name5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole
SMILESc1c[nH]c(-c2ccc(-c3nn[nH]n3)cc2)n1
InChIInChI=1S/C10H8N6/c1-3-8(10-13-15-16-14-10)4-2-7(1)9-11-5-6-12-9/h1-6H,(H,11,12)(H,13,14,15,16)
InChIKeyZOJXHSDXUDSHOM-UHFFFAOYSA-N
XLogP1.26
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.22
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole 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

5-[4-[2-[4-(2H-tetrazol-5-yl)phenyl]ethyl]phenyl]-2H-tetrazole
CID 15279617
CID 175020702
CID 175020702
1,3-bis[4-(1H-imidazol-2-yl)phenyl]-4,5,6,7-tetrahydro-2H-isoindole;dihydrochloride
CID 23301389
5-(1H-imidazol-2-yl)-2H-benzotriazole
CID 90983409
2-[4-[[4-(1H-imidazol-2-yl)phenoxy]methoxy]phenyl]-1H-imidazole;methane;dihydrochloride
CID 159025914
4-(1H-imidazol-2-yl)benzoic acid;hydrochloride
CID 68829715
5-[4-[2,2-diphenyl-1-[4-(2H-tetrazol-5-yl)phenyl]ethenyl]phenyl]-2H-tetrazole
CID 146430659
5-(4-ethylsulfanylphenyl)-2H-tetrazole
CID 82650245
molecular hydrogen;5-(4-propan-2-ylphenyl)-2H-tetrazole
CID 142506375
[2-(4-methylphenyl)-2-oxoethyl] 4-(1H-imidazol-2-yl)benzoate
CID 23915920
ethane;molecular hydrogen;5-(4-propan-2-ylphenyl)-2H-tetrazole
CID 145087204
4-(2H-tetrazol-5-yl)benzohydrazide
CID 43091169

Frequently Asked Questions

What is the IUPAC name of 5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole?
The IUPAC name of 5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole (CID 123654814) is 5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole.
What is the SMILES notation for 5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole?
The canonical SMILES for 5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole is c1c[nH]c(-c2ccc(-c3nn[nH]n3)cc2)n1.
What is the InChIKey of 5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole?
The InChIKey is ZOJXHSDXUDSHOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N6/c1-3-8(10-13-15-16-14-10)4-2-7(1)9-11-5-6-12-9/h1-6H,(H,11,12)(H,13,14,15,16).
What are the key properties of 5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole?
5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole has a molecular weight of 212.22 g/mol, XLogP of 1.26, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(1H-imidazol-2-yl)phenyl]-2H-tetrazole is sourced from PubChem (CID 123654814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).