2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine

C10H12FN3O — CID 139983031

IUPAC2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine
SMILESCOc1c(F)ccc2cnn(CCN)c12
InChIInChI=1S/C10H12FN3O/c1-15-10-8(11)3-2-7-6-13-14(5-4-12)9(7)10/h2-3,6H,4-5,12H2,1H3
InChIKeyDHOOJLHFPHQXJX-UHFFFAOYSA-N
MW209.22 g/mol
LogP1.14
Rot. Bonds3

About 2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine

2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine (PubChem CID 139983031) has the molecular formula C10H12FN3O and a molecular weight of 209.22 g/mol. Its IUPAC name is 2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine.

Molecular Properties

Compound Name2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine
PubChem CID139983031
Molecular FormulaC10H12FN3O
Molecular Weight209.22 g/mol
Exact Mass209.10
IUPAC Name2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine
SMILESCOc1c(F)ccc2cnn(CCN)c12
InChIInChI=1S/C10H12FN3O/c1-15-10-8(11)3-2-7-6-13-14(5-4-12)9(7)10/h2-3,6H,4-5,12H2,1H3
InChIKeyDHOOJLHFPHQXJX-UHFFFAOYSA-N
XLogP1.14
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine?
The IUPAC name of 2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine (CID 139983031) is 2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine.
What is the SMILES notation for 2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine?
The canonical SMILES for 2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine is COc1c(F)ccc2cnn(CCN)c12.
What is the InChIKey of 2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine?
The InChIKey is DHOOJLHFPHQXJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3O/c1-15-10-8(11)3-2-7-6-13-14(5-4-12)9(7)10/h2-3,6H,4-5,12H2,1H3.
What are the key properties of 2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine?
2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine has a molecular weight of 209.22 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-7-methoxyindazol-1-yl)ethanamine is sourced from PubChem (CID 139983031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).