methyl 2-(5-methylindazol-1-yl)acetate

C11H12N2O2 — CID 13337773

IUPACmethyl 2-(5-methylindazol-1-yl)acetate
SMILESCOC(=O)Cn1ncc2cc(C)ccc21
InChIInChI=1S/C11H12N2O2/c1-8-3-4-10-9(5-8)6-12-13(10)7-11(14)15-2/h3-6H,7H2,1-2H3
InChIKeyKLSOMOGOAMIMNN-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.52
Rot. Bonds2

About methyl 2-(5-methylindazol-1-yl)acetate

methyl 2-(5-methylindazol-1-yl)acetate (PubChem CID 13337773) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is methyl 2-(5-methylindazol-1-yl)acetate.

Molecular Properties

Compound Namemethyl 2-(5-methylindazol-1-yl)acetate
PubChem CID13337773
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Namemethyl 2-(5-methylindazol-1-yl)acetate
SMILESCOC(=O)Cn1ncc2cc(C)ccc21
InChIInChI=1S/C11H12N2O2/c1-8-3-4-10-9(5-8)6-12-13(10)7-11(14)15-2/h3-6H,7H2,1-2H3
InChIKeyKLSOMOGOAMIMNN-UHFFFAOYSA-N
XLogP1.52
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze methyl 2-(5-methylindazol-1-yl)acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2-(4-methyl-6-oxopyridazin-1-yl)acetate
CID 106548424
methyl 2-[5-(2-carbazol-9-ylethoxy)indazol-1-yl]acetate
CID 166044917
N-(3-methoxypropyl)-2-(6-methylindazol-1-yl)acetamide
CID 22509905
5-methyl-1-prop-2-ynylindazole
CID 58763635
methyl 1,5-dimethyl-4-[3-(5-methylindazol-1-yl)propanoylamino]pyrazole-3-carboxylate
CID 95748276
methyl 2-(6-bromo-7-methoxyindazol-1-yl)acetate
CID 168932025
2-(5-ethoxycarbonylindazol-1-yl)acetic acid
CID 18388152
2-(5-aminoindazol-1-yl)-N-methylacetamide
CID 89156128
ethyl 2-[6-[(2-chloroacetyl)amino]indazol-1-yl]acetate
CID 166403884
N-(3,5-dimethylphenyl)-2-indazol-1-ylacetamide
CID 20885361
N-methyl-2-(5-propylindazol-1-yl)acetamide
CID 156799155
methyl 2-(7,8-dimethoxy-1-oxophthalazin-2-yl)acetate
CID 45490728

Frequently Asked Questions

What is the IUPAC name of methyl 2-(5-methylindazol-1-yl)acetate?
The IUPAC name of methyl 2-(5-methylindazol-1-yl)acetate (CID 13337773) is methyl 2-(5-methylindazol-1-yl)acetate.
What is the SMILES notation for methyl 2-(5-methylindazol-1-yl)acetate?
The canonical SMILES for methyl 2-(5-methylindazol-1-yl)acetate is COC(=O)Cn1ncc2cc(C)ccc21.
What is the InChIKey of methyl 2-(5-methylindazol-1-yl)acetate?
The InChIKey is KLSOMOGOAMIMNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-8-3-4-10-9(5-8)6-12-13(10)7-11(14)15-2/h3-6H,7H2,1-2H3.
What are the key properties of methyl 2-(5-methylindazol-1-yl)acetate?
methyl 2-(5-methylindazol-1-yl)acetate has a molecular weight of 204.23 g/mol, XLogP of 1.52, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(5-methylindazol-1-yl)acetate is sourced from PubChem (CID 13337773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).