2-(3-methoxyphenyl)indazole

C14H12N2O — CID 3067342

IUPAC2-(3-methoxyphenyl)indazole
SMILESCOc1cccc(-n2cc3ccccc3n2)c1
InChIInChI=1S/C14H12N2O/c1-17-13-7-4-6-12(9-13)16-10-11-5-2-3-8-14(11)15-16/h2-10H,1H3
InChIKeyJNQANLFHMOCZAS-UHFFFAOYSA-N
MW224.26 g/mol
LogP3.03
Rot. Bonds2

About 2-(3-methoxyphenyl)indazole

2-(3-methoxyphenyl)indazole (PubChem CID 3067342) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)indazole.

Molecular Properties

Compound Name2-(3-methoxyphenyl)indazole
PubChem CID3067342
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name2-(3-methoxyphenyl)indazole
SMILESCOc1cccc(-n2cc3ccccc3n2)c1
InChIInChI=1S/C14H12N2O/c1-17-13-7-4-6-12(9-13)16-10-11-5-2-3-8-14(11)15-16/h2-10H,1H3
InChIKeyJNQANLFHMOCZAS-UHFFFAOYSA-N
XLogP3.03
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)indazole?
The IUPAC name of 2-(3-methoxyphenyl)indazole (CID 3067342) is 2-(3-methoxyphenyl)indazole.
What is the SMILES notation for 2-(3-methoxyphenyl)indazole?
The canonical SMILES for 2-(3-methoxyphenyl)indazole is COc1cccc(-n2cc3ccccc3n2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)indazole?
The InChIKey is JNQANLFHMOCZAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c1-17-13-7-4-6-12(9-13)16-10-11-5-2-3-8-14(11)15-16/h2-10H,1H3.
What are the key properties of 2-(3-methoxyphenyl)indazole?
2-(3-methoxyphenyl)indazole has a molecular weight of 224.26 g/mol, XLogP of 3.03, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)indazole is sourced from PubChem (CID 3067342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).