7-(2H-tetrazol-5-yl)-1H-indazole

C8H6N6 — CID 44586041

IUPAC7-(2H-tetrazol-5-yl)-1H-indazole
SMILESc1cc(-c2nn[nH]n2)c2[nH]ncc2c1
InChIInChI=1S/C8H6N6/c1-2-5-4-9-10-7(5)6(3-1)8-11-13-14-12-8/h1-4H,(H,9,10)(H,11,12,13,14)
InChIKeyALKJXNLKWJSZDV-UHFFFAOYSA-N
MW186.18 g/mol
LogP0.74
Rot. Bonds1

About 7-(2H-tetrazol-5-yl)-1H-indazole

7-(2H-tetrazol-5-yl)-1H-indazole (PubChem CID 44586041) has the molecular formula C8H6N6 and a molecular weight of 186.18 g/mol. Its IUPAC name is 7-(2H-tetrazol-5-yl)-1H-indazole.

Molecular Properties

Compound Name7-(2H-tetrazol-5-yl)-1H-indazole
PubChem CID44586041
Molecular FormulaC8H6N6
Molecular Weight186.18 g/mol
Exact Mass186.07
IUPAC Name7-(2H-tetrazol-5-yl)-1H-indazole
SMILESc1cc(-c2nn[nH]n2)c2[nH]ncc2c1
InChIInChI=1S/C8H6N6/c1-2-5-4-9-10-7(5)6(3-1)8-11-13-14-12-8/h1-4H,(H,9,10)(H,11,12,13,14)
InChIKeyALKJXNLKWJSZDV-UHFFFAOYSA-N
XLogP0.74
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.18
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

7-Methyl-1H-indazole
CID 820797
1H-Indazole-7-carbonitrile
CID 25022685
5-(1H-1,2,3-triazol-4-yl)-1H-indazole
CID 25165860
5-(1H-indazol-5-yl)-1,3,4-thiadiazol-2-amine
CID 67091741
5-(2-(2H-Tetrazol-5-yl)ethyl)-1H-indazol-1-ol
CID 71695771
5-(1H-pyrazol-3-yl)-1H-indazol-3-amine
CID 44570386
3-methyl-5-(1H-pyrazol-4-yl)-2H-indazole
CID 122196353
7-(1H-[1,2,3]Triazol-5-yl)-1H-indazole
CID 44585509
1-methyl-5-[2-(2H-tetrazol-5-yl)ethyl]indazole
CID 117827225
5-[4-(1H-pyrazol-5-yl)phenyl]-2H-tetrazole
CID 141379105
5,7-Dimethyl-1H-indazole
CID 589751
3-(4-fluorophenyl)-5-(2H-tetrazol-5-yl)-1H-indazole
CID 9795679

Frequently Asked Questions

What is the IUPAC name of 7-(2H-tetrazol-5-yl)-1H-indazole?
The IUPAC name of 7-(2H-tetrazol-5-yl)-1H-indazole (CID 44586041) is 7-(2H-tetrazol-5-yl)-1H-indazole.
What is the SMILES notation for 7-(2H-tetrazol-5-yl)-1H-indazole?
The canonical SMILES for 7-(2H-tetrazol-5-yl)-1H-indazole is c1cc(-c2nn[nH]n2)c2[nH]ncc2c1.
What is the InChIKey of 7-(2H-tetrazol-5-yl)-1H-indazole?
The InChIKey is ALKJXNLKWJSZDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N6/c1-2-5-4-9-10-7(5)6(3-1)8-11-13-14-12-8/h1-4H,(H,9,10)(H,11,12,13,14).
What are the key properties of 7-(2H-tetrazol-5-yl)-1H-indazole?
7-(2H-tetrazol-5-yl)-1H-indazole has a molecular weight of 186.18 g/mol, XLogP of 0.74, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2H-tetrazol-5-yl)-1H-indazole is sourced from PubChem (CID 44586041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).