2-methoxy-3-methylindazole

C9H10N2O — CID 12791910

IUPAC2-methoxy-3-methylindazole
SMILESCOn1nc2ccccc2c1C
InChIInChI=1S/C9H10N2O/c1-7-8-5-3-4-6-9(8)10-11(7)12-2/h3-6H,1-2H3
InChIKeyKRBSLALRZKWKIE-UHFFFAOYSA-N
MW162.19 g/mol
LogP1.40
Rot. Bonds1

About 2-methoxy-3-methylindazole

2-methoxy-3-methylindazole (PubChem CID 12791910) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is 2-methoxy-3-methylindazole.

Molecular Properties

Compound Name2-methoxy-3-methylindazole
PubChem CID12791910
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Name2-methoxy-3-methylindazole
SMILESCOn1nc2ccccc2c1C
InChIInChI=1S/C9H10N2O/c1-7-8-5-3-4-6-9(8)10-11(7)12-2/h3-6H,1-2H3
InChIKeyKRBSLALRZKWKIE-UHFFFAOYSA-N
XLogP1.40
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3-methylindazole?
The IUPAC name of 2-methoxy-3-methylindazole (CID 12791910) is 2-methoxy-3-methylindazole.
What is the SMILES notation for 2-methoxy-3-methylindazole?
The canonical SMILES for 2-methoxy-3-methylindazole is COn1nc2ccccc2c1C.
What is the InChIKey of 2-methoxy-3-methylindazole?
The InChIKey is KRBSLALRZKWKIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O/c1-7-8-5-3-4-6-9(8)10-11(7)12-2/h3-6H,1-2H3.
What are the key properties of 2-methoxy-3-methylindazole?
2-methoxy-3-methylindazole has a molecular weight of 162.19 g/mol, XLogP of 1.40, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-methylindazole is sourced from PubChem (CID 12791910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).