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

C8H9N3O — CID 27274712

IUPAC6-methoxy-1H-indazol-5-amine
SMILESCOc1cc2[nH]ncc2cc1N
InChIInChI=1S/C8H9N3O/c1-12-8-3-7-5(2-6(8)9)4-10-11-7/h2-4H,9H2,1H3,(H,10,11)
InChIKeyGHEKVHASRAQCNU-UHFFFAOYSA-N
MW163.18 g/mol
LogP1.15
Rot. Bonds1

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

6-methoxy-1H-indazol-5-amine (PubChem CID 27274712) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is 6-methoxy-1H-indazol-5-amine.

Molecular Properties

Compound Name6-methoxy-1H-indazol-5-amine
PubChem CID27274712
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC Name6-methoxy-1H-indazol-5-amine
SMILESCOc1cc2[nH]ncc2cc1N
InChIInChI=1S/C8H9N3O/c1-12-8-3-7-5(2-6(8)9)4-10-11-7/h2-4H,9H2,1H3,(H,10,11)
InChIKeyGHEKVHASRAQCNU-UHFFFAOYSA-N
XLogP1.15
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

7-Methoxyindazole
CID 10441839
5-Methoxy-1H-indazole
CID 13346860
4-Methoxy-1H-indazole
CID 24729333
6-Methoxy-1H-indazole
CID 12639202
5-Bromo-6-methoxy-1H-indazole
CID 15278593
6-methoxy-4-phenyl-1H-indazole
CID 127046307
4-phenyl-6-(trifluoromethoxy)-1H-indazole
CID 127046309
6-(Benzyloxy)-1H-indazole
CID 11535911
6-methoxy-1H-indazol-3-amine
CID 21409192
5,6-Dimethoxy-1H-indazole
CID 19839198
7-Ethoxy-1H-indazole
CID 44270467
6-(4-methoxyphenyl)-1H-indazole
CID 72923141

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1H-indazol-5-amine?
The IUPAC name of 6-methoxy-1H-indazol-5-amine (CID 27274712) is 6-methoxy-1H-indazol-5-amine.
What is the SMILES notation for 6-methoxy-1H-indazol-5-amine?
The canonical SMILES for 6-methoxy-1H-indazol-5-amine is COc1cc2[nH]ncc2cc1N.
What is the InChIKey of 6-methoxy-1H-indazol-5-amine?
The InChIKey is GHEKVHASRAQCNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c1-12-8-3-7-5(2-6(8)9)4-10-11-7/h2-4H,9H2,1H3,(H,10,11).
What are the key properties of 6-methoxy-1H-indazol-5-amine?
6-methoxy-1H-indazol-5-amine has a molecular weight of 163.18 g/mol, XLogP of 1.15, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1H-indazol-5-amine is sourced from PubChem (CID 27274712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).