(7-methoxy-1H-indazol-5-yl)methanamine

C9H11N3O — CID 82599475

IUPAC(7-methoxy-1H-indazol-5-yl)methanamine
SMILESCOc1cc(CN)cc2cn[nH]c12
InChIInChI=1S/C9H11N3O/c1-13-8-3-6(4-10)2-7-5-11-12-9(7)8/h2-3,5H,4,10H2,1H3,(H,11,12)
InChIKeyOTHDAHOMAIXXRM-UHFFFAOYSA-N
MW177.21 g/mol
LogP1.03
Rot. Bonds2

About (7-methoxy-1H-indazol-5-yl)methanamine

(7-methoxy-1H-indazol-5-yl)methanamine (PubChem CID 82599475) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is (7-methoxy-1H-indazol-5-yl)methanamine.

Molecular Properties

Compound Name(7-methoxy-1H-indazol-5-yl)methanamine
PubChem CID82599475
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name(7-methoxy-1H-indazol-5-yl)methanamine
SMILESCOc1cc(CN)cc2cn[nH]c12
InChIInChI=1S/C9H11N3O/c1-13-8-3-6(4-10)2-7-5-11-12-9(7)8/h2-3,5H,4,10H2,1H3,(H,11,12)
InChIKeyOTHDAHOMAIXXRM-UHFFFAOYSA-N
XLogP1.03
TPSA63.93 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 ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-7-methoxy-1H-indazole
CID 83669485
(6-methoxy-1H-indazol-5-yl)methanamine
CID 117109494
1H-pyrazolo[5,4-b]pyridin-5-ylmethanamine
CID 69178714
(7-methoxy-3-methyl-2H-indazol-5-yl)methanamine
CID 117109639
3-(7-methoxy-1H-indazol-5-yl)-N-methyl-3-phenylpropan-1-amine
CID 59831836
(7-methoxy-1-benzothiophen-5-yl)methanamine
CID 130050630
[3,4-dimethoxy-5-(5-pyridin-3-yl-1H-pyrazol-4-yl)phenyl]methanamine
CID 39222393
2-amino-4-(aminomethyl)-6-methoxyphenol
CID 91902669
methyl 2-amino-3-(7-chloro-1H-indazol-5-yl)propanoate
CID 58864314
methyl 2-amino-3-(7-ethyl-1H-indazol-5-yl)propanoate
CID 58864508
(3-bromo-4-chloro-5-methoxyphenyl)methanamine
CID 122129661
7-methoxy-1H-indazol-4-amine
CID 171597914

Frequently Asked Questions

What is the IUPAC name of (7-methoxy-1H-indazol-5-yl)methanamine?
The IUPAC name of (7-methoxy-1H-indazol-5-yl)methanamine (CID 82599475) is (7-methoxy-1H-indazol-5-yl)methanamine.
What is the SMILES notation for (7-methoxy-1H-indazol-5-yl)methanamine?
The canonical SMILES for (7-methoxy-1H-indazol-5-yl)methanamine is COc1cc(CN)cc2cn[nH]c12.
What is the InChIKey of (7-methoxy-1H-indazol-5-yl)methanamine?
The InChIKey is OTHDAHOMAIXXRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c1-13-8-3-6(4-10)2-7-5-11-12-9(7)8/h2-3,5H,4,10H2,1H3,(H,11,12).
What are the key properties of (7-methoxy-1H-indazol-5-yl)methanamine?
(7-methoxy-1H-indazol-5-yl)methanamine has a molecular weight of 177.21 g/mol, XLogP of 1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methoxy-1H-indazol-5-yl)methanamine is sourced from PubChem (CID 82599475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).