2-(5-methoxy-1-methylindazol-6-yl)ethanamine

C11H15N3O — CID 135381626

IUPAC2-(5-methoxy-1-methylindazol-6-yl)ethanamine
SMILESCOc1cc2cnn(C)c2cc1CCN
InChIInChI=1S/C11H15N3O/c1-14-10-5-8(3-4-12)11(15-2)6-9(10)7-13-14/h5-7H,3-4,12H2,1-2H3
InChIKeyJQUIFUWUTBBYAT-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.08
Rot. Bonds3

About 2-(5-methoxy-1-methylindazol-6-yl)ethanamine

2-(5-methoxy-1-methylindazol-6-yl)ethanamine (PubChem CID 135381626) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 2-(5-methoxy-1-methylindazol-6-yl)ethanamine.

Molecular Properties

Compound Name2-(5-methoxy-1-methylindazol-6-yl)ethanamine
PubChem CID135381626
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name2-(5-methoxy-1-methylindazol-6-yl)ethanamine
SMILESCOc1cc2cnn(C)c2cc1CCN
InChIInChI=1S/C11H15N3O/c1-14-10-5-8(3-4-12)11(15-2)6-9(10)7-13-14/h5-7H,3-4,12H2,1-2H3
InChIKeyJQUIFUWUTBBYAT-UHFFFAOYSA-N
XLogP1.08
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methoxy-1-methylindazol-6-yl)ethanamine?
The IUPAC name of 2-(5-methoxy-1-methylindazol-6-yl)ethanamine (CID 135381626) is 2-(5-methoxy-1-methylindazol-6-yl)ethanamine.
What is the SMILES notation for 2-(5-methoxy-1-methylindazol-6-yl)ethanamine?
The canonical SMILES for 2-(5-methoxy-1-methylindazol-6-yl)ethanamine is COc1cc2cnn(C)c2cc1CCN.
What is the InChIKey of 2-(5-methoxy-1-methylindazol-6-yl)ethanamine?
The InChIKey is JQUIFUWUTBBYAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-14-10-5-8(3-4-12)11(15-2)6-9(10)7-13-14/h5-7H,3-4,12H2,1-2H3.
What are the key properties of 2-(5-methoxy-1-methylindazol-6-yl)ethanamine?
2-(5-methoxy-1-methylindazol-6-yl)ethanamine has a molecular weight of 205.26 g/mol, XLogP of 1.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methoxy-1-methylindazol-6-yl)ethanamine is sourced from PubChem (CID 135381626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).