5-(methoxymethyl)-1H-indazole

C9H10N2O — CID 123206066

IUPAC5-(methoxymethyl)-1H-indazole
SMILESCOCc1ccc2[nH]ncc2c1
InChIInChI=1S/C9H10N2O/c1-12-6-7-2-3-9-8(4-7)5-10-11-9/h2-5H,6H2,1H3,(H,10,11)
InChIKeyWCNLEDGRPIQMNP-UHFFFAOYSA-N
MW162.19 g/mol
LogP1.71
Rot. Bonds2

About 5-(methoxymethyl)-1H-indazole

5-(methoxymethyl)-1H-indazole (PubChem CID 123206066) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is 5-(methoxymethyl)-1H-indazole.

Molecular Properties

Compound Name5-(methoxymethyl)-1H-indazole
PubChem CID123206066
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Name5-(methoxymethyl)-1H-indazole
SMILESCOCc1ccc2[nH]ncc2c1
InChIInChI=1S/C9H10N2O/c1-12-6-7-2-3-9-8(4-7)5-10-11-9/h2-5H,6H2,1H3,(H,10,11)
InChIKeyWCNLEDGRPIQMNP-UHFFFAOYSA-N
XLogP1.71
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-1H-indazole?
The IUPAC name of 5-(methoxymethyl)-1H-indazole (CID 123206066) is 5-(methoxymethyl)-1H-indazole.
What is the SMILES notation for 5-(methoxymethyl)-1H-indazole?
The canonical SMILES for 5-(methoxymethyl)-1H-indazole is COCc1ccc2[nH]ncc2c1.
What is the InChIKey of 5-(methoxymethyl)-1H-indazole?
The InChIKey is WCNLEDGRPIQMNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O/c1-12-6-7-2-3-9-8(4-7)5-10-11-9/h2-5H,6H2,1H3,(H,10,11).
What are the key properties of 5-(methoxymethyl)-1H-indazole?
5-(methoxymethyl)-1H-indazole has a molecular weight of 162.19 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-1H-indazole is sourced from PubChem (CID 123206066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).