3-(3-ethenylphenyl)-1H-indazole

C15H12N2 — CID 102196419

IUPAC3-(3-ethenylphenyl)-1H-indazole
SMILESC=Cc1cccc(-c2n[nH]c3ccccc23)c1
InChIInChI=1S/C15H12N2/c1-2-11-6-5-7-12(10-11)15-13-8-3-4-9-14(13)16-17-15/h2-10H,1H2,(H,16,17)
InChIKeyQFFDZRJXWFRYLF-UHFFFAOYSA-N
MW220.27 g/mol
LogP3.87
Rot. Bonds2

About 3-(3-ethenylphenyl)-1H-indazole

3-(3-ethenylphenyl)-1H-indazole (PubChem CID 102196419) has the molecular formula C15H12N2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 3-(3-ethenylphenyl)-1H-indazole.

Molecular Properties

Compound Name3-(3-ethenylphenyl)-1H-indazole
PubChem CID102196419
Molecular FormulaC15H12N2
Molecular Weight220.27 g/mol
Exact Mass220.10
IUPAC Name3-(3-ethenylphenyl)-1H-indazole
SMILESC=Cc1cccc(-c2n[nH]c3ccccc23)c1
InChIInChI=1S/C15H12N2/c1-2-11-6-5-7-12(10-11)15-13-8-3-4-9-14(13)16-17-15/h2-10H,1H2,(H,16,17)
InChIKeyQFFDZRJXWFRYLF-UHFFFAOYSA-N
XLogP3.87
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(3-ethenylphenyl)-1H-indazole?
The IUPAC name of 3-(3-ethenylphenyl)-1H-indazole (CID 102196419) is 3-(3-ethenylphenyl)-1H-indazole.
What is the SMILES notation for 3-(3-ethenylphenyl)-1H-indazole?
The canonical SMILES for 3-(3-ethenylphenyl)-1H-indazole is C=Cc1cccc(-c2n[nH]c3ccccc23)c1.
What is the InChIKey of 3-(3-ethenylphenyl)-1H-indazole?
The InChIKey is QFFDZRJXWFRYLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2/c1-2-11-6-5-7-12(10-11)15-13-8-3-4-9-14(13)16-17-15/h2-10H,1H2,(H,16,17).
What are the key properties of 3-(3-ethenylphenyl)-1H-indazole?
3-(3-ethenylphenyl)-1H-indazole has a molecular weight of 220.27 g/mol, XLogP of 3.87, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethenylphenyl)-1H-indazole is sourced from PubChem (CID 102196419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).