7-methoxy-1H-indazol-4-amine

C8H9N3O — CID 171597914

IUPAC7-methoxy-1H-indazol-4-amine
SMILESCOc1ccc(N)c2cn[nH]c12
InChIInChI=1S/C8H9N3O/c1-12-7-3-2-6(9)5-4-10-11-8(5)7/h2-4H,9H2,1H3,(H,10,11)
InChIKeySMXOSGLIFAWNLB-UHFFFAOYSA-N
MW163.18 g/mol
LogP1.15
Rot. Bonds1

About 7-methoxy-1H-indazol-4-amine

7-methoxy-1H-indazol-4-amine (PubChem CID 171597914) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is 7-methoxy-1H-indazol-4-amine.

Molecular Properties

Compound Name7-methoxy-1H-indazol-4-amine
PubChem CID171597914
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC Name7-methoxy-1H-indazol-4-amine
SMILESCOc1ccc(N)c2cn[nH]c12
InChIInChI=1S/C8H9N3O/c1-12-7-3-2-6(9)5-4-10-11-8(5)7/h2-4H,9H2,1H3,(H,10,11)
InChIKeySMXOSGLIFAWNLB-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

5-methoxy-1H-indazol-4-amine
CID 76845989
4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine
CID 86717818
2,3,4-trimethoxyaniline
CID 15455622
4-methoxy-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole
CID 155978029
4-(7-methoxy-1H-indol-4-yl)-1H-pyrazol-5-amine
CID 117328786
7,8-dimethoxy-1H-cinnolin-4-one
CID 86018702
5-(3,4-dimethoxyphenyl)-1H-pyrazolo[4,5-d]pyrimidin-7-amine
CID 141346954
4-bromo-5-methoxy-1H-indazole
CID 46941913
7-methoxy-1H-benzimidazole-2,4-diamine
CID 130849289
3-(7-methoxy-1H-indazol-4-yl)-3-phenylbutanamide
CID 90931792
4-methoxy-2,3-dimethylaniline
CID 11094809
(3S)-3-(7-methoxy-1H-indazol-4-yl)-N-methyl-3-phenylpropanamide
CID 59831721

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-1H-indazol-4-amine?
The IUPAC name of 7-methoxy-1H-indazol-4-amine (CID 171597914) is 7-methoxy-1H-indazol-4-amine.
What is the SMILES notation for 7-methoxy-1H-indazol-4-amine?
The canonical SMILES for 7-methoxy-1H-indazol-4-amine is COc1ccc(N)c2cn[nH]c12.
What is the InChIKey of 7-methoxy-1H-indazol-4-amine?
The InChIKey is SMXOSGLIFAWNLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c1-12-7-3-2-6(9)5-4-10-11-8(5)7/h2-4H,9H2,1H3,(H,10,11).
What are the key properties of 7-methoxy-1H-indazol-4-amine?
7-methoxy-1H-indazol-4-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 7-methoxy-1H-indazol-4-amine is sourced from PubChem (CID 171597914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).