2-ethyl-5-methoxyindazole

C10H12N2O — CID 10856015

IUPAC2-ethyl-5-methoxyindazole
SMILESCCn1cc2cc(OC)ccc2n1
InChIInChI=1S/C10H12N2O/c1-3-12-7-8-6-9(13-2)4-5-10(8)11-12/h4-7H,3H2,1-2H3
InChIKeyUAYICWVQWQMACY-UHFFFAOYSA-N
MW176.22 g/mol
LogP2.06
Rot. Bonds2

About 2-ethyl-5-methoxyindazole

2-ethyl-5-methoxyindazole (PubChem CID 10856015) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 2-ethyl-5-methoxyindazole.

Molecular Properties

Compound Name2-ethyl-5-methoxyindazole
PubChem CID10856015
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name2-ethyl-5-methoxyindazole
SMILESCCn1cc2cc(OC)ccc2n1
InChIInChI=1S/C10H12N2O/c1-3-12-7-8-6-9(13-2)4-5-10(8)11-12/h4-7H,3H2,1-2H3
InChIKeyUAYICWVQWQMACY-UHFFFAOYSA-N
XLogP2.06
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-methoxyindazole?
The IUPAC name of 2-ethyl-5-methoxyindazole (CID 10856015) is 2-ethyl-5-methoxyindazole.
What is the SMILES notation for 2-ethyl-5-methoxyindazole?
The canonical SMILES for 2-ethyl-5-methoxyindazole is CCn1cc2cc(OC)ccc2n1.
What is the InChIKey of 2-ethyl-5-methoxyindazole?
The InChIKey is UAYICWVQWQMACY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-3-12-7-8-6-9(13-2)4-5-10(8)11-12/h4-7H,3H2,1-2H3.
What are the key properties of 2-ethyl-5-methoxyindazole?
2-ethyl-5-methoxyindazole has a molecular weight of 176.22 g/mol, XLogP of 2.06, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-methoxyindazole is sourced from PubChem (CID 10856015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).