6-(cyclopropylmethoxy)-2-phenylindazole

C17H16N2O — CID 141339260

IUPAC6-(cyclopropylmethoxy)-2-phenylindazole
SMILESc1ccc(-n2cc3ccc(OCC4CC4)cc3n2)cc1
InChIInChI=1S/C17H16N2O/c1-2-4-15(5-3-1)19-11-14-8-9-16(10-17(14)18-19)20-12-13-6-7-13/h1-5,8-11,13H,6-7,12H2
InChIKeyKEUQNOOYIOENHF-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.81
Rot. Bonds4

About 6-(cyclopropylmethoxy)-2-phenylindazole

6-(cyclopropylmethoxy)-2-phenylindazole (PubChem CID 141339260) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 6-(cyclopropylmethoxy)-2-phenylindazole.

Molecular Properties

Compound Name6-(cyclopropylmethoxy)-2-phenylindazole
PubChem CID141339260
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name6-(cyclopropylmethoxy)-2-phenylindazole
SMILESc1ccc(-n2cc3ccc(OCC4CC4)cc3n2)cc1
InChIInChI=1S/C17H16N2O/c1-2-4-15(5-3-1)19-11-14-8-9-16(10-17(14)18-19)20-12-13-6-7-13/h1-5,8-11,13H,6-7,12H2
InChIKeyKEUQNOOYIOENHF-UHFFFAOYSA-N
XLogP3.81
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylmethoxy)-2-phenylindazole?
The IUPAC name of 6-(cyclopropylmethoxy)-2-phenylindazole (CID 141339260) is 6-(cyclopropylmethoxy)-2-phenylindazole.
What is the SMILES notation for 6-(cyclopropylmethoxy)-2-phenylindazole?
The canonical SMILES for 6-(cyclopropylmethoxy)-2-phenylindazole is c1ccc(-n2cc3ccc(OCC4CC4)cc3n2)cc1.
What is the InChIKey of 6-(cyclopropylmethoxy)-2-phenylindazole?
The InChIKey is KEUQNOOYIOENHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-2-4-15(5-3-1)19-11-14-8-9-16(10-17(14)18-19)20-12-13-6-7-13/h1-5,8-11,13H,6-7,12H2.
What are the key properties of 6-(cyclopropylmethoxy)-2-phenylindazole?
6-(cyclopropylmethoxy)-2-phenylindazole has a molecular weight of 264.33 g/mol, XLogP of 3.81, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylmethoxy)-2-phenylindazole is sourced from PubChem (CID 141339260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).