Ethyl 3-(4-cyano-1H-indazol-1-yl)-2,2-dimethylpropanoate

HCID 59316699
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Basic information

Standard SMILES
CCOC(=O)C(C)(C)Cn1ncc2c(C#N)cccc21
InChIKey
LQSOMRWKORWIJK-UHFFFAOYSA-N
Molecular formula
C15H17N3O2
Average molar mass
271.31 g/mol

Names & identifiers

Preferred name
Ethyl 3-(4-cyano-1H-indazol-1-yl)-2,2-dimethylpropanoate
IUPAC
ethyl 3-(4-cyanoindazol-1-yl)-2,2-dimethylpropanoate

Names & synonyms

SCHEMBL1398630LQSOMRWKORWIJK-UHFFFAOYSA-NEthyl 3-(4-cyano-1H-indazol-1-yl)-2,2-dimethylpropanoate

Database identifiers

PubChem CID
59316699

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
67.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
20

Related reactions

6 records
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Compound notes

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