6-methoxy-N-methyl-1H-indazol-5-amine

C9H11N3O — CID 153364692

IUPAC6-methoxy-N-methyl-1H-indazol-5-amine
SMILESCNc1cc2cn[nH]c2cc1OC
InChIInChI=1S/C9H11N3O/c1-10-8-3-6-5-11-12-7(6)4-9(8)13-2/h3-5,10H,1-2H3,(H,11,12)
InChIKeyGTKGVMFQSRGOPZ-UHFFFAOYSA-N
MW177.21 g/mol
LogP1.61
Rot. Bonds2

About 6-methoxy-N-methyl-1H-indazol-5-amine

6-methoxy-N-methyl-1H-indazol-5-amine (PubChem CID 153364692) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is 6-methoxy-N-methyl-1H-indazol-5-amine.

Molecular Properties

Compound Name6-methoxy-N-methyl-1H-indazol-5-amine
PubChem CID153364692
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name6-methoxy-N-methyl-1H-indazol-5-amine
SMILESCNc1cc2cn[nH]c2cc1OC
InChIInChI=1S/C9H11N3O/c1-10-8-3-6-5-11-12-7(6)4-9(8)13-2/h3-5,10H,1-2H3,(H,11,12)
InChIKeyGTKGVMFQSRGOPZ-UHFFFAOYSA-N
XLogP1.61
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-methyl-1H-indazol-5-amine?
The IUPAC name of 6-methoxy-N-methyl-1H-indazol-5-amine (CID 153364692) is 6-methoxy-N-methyl-1H-indazol-5-amine.
What is the SMILES notation for 6-methoxy-N-methyl-1H-indazol-5-amine?
The canonical SMILES for 6-methoxy-N-methyl-1H-indazol-5-amine is CNc1cc2cn[nH]c2cc1OC.
What is the InChIKey of 6-methoxy-N-methyl-1H-indazol-5-amine?
The InChIKey is GTKGVMFQSRGOPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c1-10-8-3-6-5-11-12-7(6)4-9(8)13-2/h3-5,10H,1-2H3,(H,11,12).
What are the key properties of 6-methoxy-N-methyl-1H-indazol-5-amine?
6-methoxy-N-methyl-1H-indazol-5-amine has a molecular weight of 177.21 g/mol, XLogP of 1.61, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-methyl-1H-indazol-5-amine is sourced from PubChem (CID 153364692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).