7-(2H-triazol-4-yl)-1H-indazole

C9H7N5 — CID 44585509

IUPAC7-(2H-triazol-4-yl)-1H-indazole
SMILESc1cc(-c2cn[nH]n2)c2[nH]ncc2c1
InChIInChI=1S/C9H7N5/c1-2-6-4-10-13-9(6)7(3-1)8-5-11-14-12-8/h1-5H,(H,10,13)(H,11,12,14)
InChIKeyOPACUJIQQAVLSY-UHFFFAOYSA-N
MW185.19 g/mol
LogP1.35
Rot. Bonds1

About 7-(2H-triazol-4-yl)-1H-indazole

7-(2H-triazol-4-yl)-1H-indazole (PubChem CID 44585509) has the molecular formula C9H7N5 and a molecular weight of 185.19 g/mol. Its IUPAC name is 7-(2H-triazol-4-yl)-1H-indazole.

Molecular Properties

Compound Name7-(2H-triazol-4-yl)-1H-indazole
PubChem CID44585509
Molecular FormulaC9H7N5
Molecular Weight185.19 g/mol
Exact Mass185.07
IUPAC Name7-(2H-triazol-4-yl)-1H-indazole
SMILESc1cc(-c2cn[nH]n2)c2[nH]ncc2c1
InChIInChI=1S/C9H7N5/c1-2-6-4-10-13-9(6)7(3-1)8-5-11-14-12-8/h1-5H,(H,10,13)(H,11,12,14)
InChIKeyOPACUJIQQAVLSY-UHFFFAOYSA-N
XLogP1.35
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.19
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-(2H-triazol-4-yl)-1H-indazole?
The IUPAC name of 7-(2H-triazol-4-yl)-1H-indazole (CID 44585509) is 7-(2H-triazol-4-yl)-1H-indazole.
What is the SMILES notation for 7-(2H-triazol-4-yl)-1H-indazole?
The canonical SMILES for 7-(2H-triazol-4-yl)-1H-indazole is c1cc(-c2cn[nH]n2)c2[nH]ncc2c1.
What is the InChIKey of 7-(2H-triazol-4-yl)-1H-indazole?
The InChIKey is OPACUJIQQAVLSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N5/c1-2-6-4-10-13-9(6)7(3-1)8-5-11-14-12-8/h1-5H,(H,10,13)(H,11,12,14).
What are the key properties of 7-(2H-triazol-4-yl)-1H-indazole?
7-(2H-triazol-4-yl)-1H-indazole has a molecular weight of 185.19 g/mol, XLogP of 1.35, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2H-triazol-4-yl)-1H-indazole is sourced from PubChem (CID 44585509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).