3-methoxy-2-phenylindazole

C14H12N2O — CID 83804677

IUPAC3-methoxy-2-phenylindazole
SMILESCOc1c2ccccc2nn1-c1ccccc1
InChIInChI=1S/C14H12N2O/c1-17-14-12-9-5-6-10-13(12)15-16(14)11-7-3-2-4-8-11/h2-10H,1H3
InChIKeyGUMUTFHNTVMVTN-UHFFFAOYSA-N
MW224.26 g/mol
LogP3.03
Rot. Bonds2

About 3-methoxy-2-phenylindazole

3-methoxy-2-phenylindazole (PubChem CID 83804677) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is 3-methoxy-2-phenylindazole.

Molecular Properties

Compound Name3-methoxy-2-phenylindazole
PubChem CID83804677
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name3-methoxy-2-phenylindazole
SMILESCOc1c2ccccc2nn1-c1ccccc1
InChIInChI=1S/C14H12N2O/c1-17-14-12-9-5-6-10-13(12)15-16(14)11-7-3-2-4-8-11/h2-10H,1H3
InChIKeyGUMUTFHNTVMVTN-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 3-methoxy-2-phenylindazole?
The IUPAC name of 3-methoxy-2-phenylindazole (CID 83804677) is 3-methoxy-2-phenylindazole.
What is the SMILES notation for 3-methoxy-2-phenylindazole?
The canonical SMILES for 3-methoxy-2-phenylindazole is COc1c2ccccc2nn1-c1ccccc1.
What is the InChIKey of 3-methoxy-2-phenylindazole?
The InChIKey is GUMUTFHNTVMVTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c1-17-14-12-9-5-6-10-13(12)15-16(14)11-7-3-2-4-8-11/h2-10H,1H3.
What are the key properties of 3-methoxy-2-phenylindazole?
3-methoxy-2-phenylindazole 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 3-methoxy-2-phenylindazole is sourced from PubChem (CID 83804677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).