5,6-dimethoxy-1-phenylindazole

C15H14N2O2 — CID 11482206

IUPAC5,6-dimethoxy-1-phenylindazole
SMILESCOc1cc2cnn(-c3ccccc3)c2cc1OC
InChIInChI=1S/C15H14N2O2/c1-18-14-8-11-10-16-17(12-6-4-3-5-7-12)13(11)9-15(14)19-2/h3-10H,1-2H3
InChIKeyPQCVRAIGXOWXMR-UHFFFAOYSA-N
MW254.29 g/mol
LogP3.04
Rot. Bonds3

About 5,6-dimethoxy-1-phenylindazole

5,6-dimethoxy-1-phenylindazole (PubChem CID 11482206) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 5,6-dimethoxy-1-phenylindazole.

Molecular Properties

Compound Name5,6-dimethoxy-1-phenylindazole
PubChem CID11482206
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name5,6-dimethoxy-1-phenylindazole
SMILESCOc1cc2cnn(-c3ccccc3)c2cc1OC
InChIInChI=1S/C15H14N2O2/c1-18-14-8-11-10-16-17(12-6-4-3-5-7-12)13(11)9-15(14)19-2/h3-10H,1-2H3
InChIKeyPQCVRAIGXOWXMR-UHFFFAOYSA-N
XLogP3.04
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5,6-dimethoxy-1-phenylindazole?
The IUPAC name of 5,6-dimethoxy-1-phenylindazole (CID 11482206) is 5,6-dimethoxy-1-phenylindazole.
What is the SMILES notation for 5,6-dimethoxy-1-phenylindazole?
The canonical SMILES for 5,6-dimethoxy-1-phenylindazole is COc1cc2cnn(-c3ccccc3)c2cc1OC.
What is the InChIKey of 5,6-dimethoxy-1-phenylindazole?
The InChIKey is PQCVRAIGXOWXMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-18-14-8-11-10-16-17(12-6-4-3-5-7-12)13(11)9-15(14)19-2/h3-10H,1-2H3.
What are the key properties of 5,6-dimethoxy-1-phenylindazole?
5,6-dimethoxy-1-phenylindazole has a molecular weight of 254.29 g/mol, XLogP of 3.04, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethoxy-1-phenylindazole is sourced from PubChem (CID 11482206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).