6-(4-methoxyphenyl)-1H-indazole

C14H12N2O — CID 72923141

IUPAC6-(4-methoxyphenyl)-1H-indazole
SMILESCOc1ccc(-c2ccc3cn[nH]c3c2)cc1
InChIInChI=1S/C14H12N2O/c1-17-13-6-4-10(5-7-13)11-2-3-12-9-15-16-14(12)8-11/h2-9H,1H3,(H,15,16)
InChIKeyBXACBLWNAGNOGV-UHFFFAOYSA-N
MW224.26 g/mol
LogP3.24
Rot. Bonds2

About 6-(4-methoxyphenyl)-1H-indazole

6-(4-methoxyphenyl)-1H-indazole (PubChem CID 72923141) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is 6-(4-methoxyphenyl)-1H-indazole.

Molecular Properties

Compound Name6-(4-methoxyphenyl)-1H-indazole
PubChem CID72923141
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name6-(4-methoxyphenyl)-1H-indazole
SMILESCOc1ccc(-c2ccc3cn[nH]c3c2)cc1
InChIInChI=1S/C14H12N2O/c1-17-13-6-4-10(5-7-13)11-2-3-12-9-15-16-14(12)8-11/h2-9H,1H3,(H,15,16)
InChIKeyBXACBLWNAGNOGV-UHFFFAOYSA-N
XLogP3.24
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(4-methoxyphenyl)-1H-indazole?
The IUPAC name of 6-(4-methoxyphenyl)-1H-indazole (CID 72923141) is 6-(4-methoxyphenyl)-1H-indazole.
What is the SMILES notation for 6-(4-methoxyphenyl)-1H-indazole?
The canonical SMILES for 6-(4-methoxyphenyl)-1H-indazole is COc1ccc(-c2ccc3cn[nH]c3c2)cc1.
What is the InChIKey of 6-(4-methoxyphenyl)-1H-indazole?
The InChIKey is BXACBLWNAGNOGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c1-17-13-6-4-10(5-7-13)11-2-3-12-9-15-16-14(12)8-11/h2-9H,1H3,(H,15,16).
What are the key properties of 6-(4-methoxyphenyl)-1H-indazole?
6-(4-methoxyphenyl)-1H-indazole has a molecular weight of 224.26 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxyphenyl)-1H-indazole is sourced from PubChem (CID 72923141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).