2-hydroxyethyl indazole-1-carboxylate

C10H10N2O3 — CID 141178752

IUPAC2-hydroxyethyl indazole-1-carboxylate
SMILESO=C(OCCO)n1ncc2ccccc21
InChIInChI=1S/C10H10N2O3/c13-5-6-15-10(14)12-9-4-2-1-3-8(9)7-11-12/h1-4,7,13H,5-6H2
InChIKeyASQFQHZKMQHQBD-UHFFFAOYSA-N
MW206.20 g/mol
LogP1.01
Rot. Bonds2

About 2-hydroxyethyl indazole-1-carboxylate

2-hydroxyethyl indazole-1-carboxylate (PubChem CID 141178752) has the molecular formula C10H10N2O3 and a molecular weight of 206.20 g/mol. Its IUPAC name is 2-hydroxyethyl indazole-1-carboxylate.

Molecular Properties

Compound Name2-hydroxyethyl indazole-1-carboxylate
PubChem CID141178752
Molecular FormulaC10H10N2O3
Molecular Weight206.20 g/mol
Exact Mass206.07
IUPAC Name2-hydroxyethyl indazole-1-carboxylate
SMILESO=C(OCCO)n1ncc2ccccc21
InChIInChI=1S/C10H10N2O3/c13-5-6-15-10(14)12-9-4-2-1-3-8(9)7-11-12/h1-4,7,13H,5-6H2
InChIKeyASQFQHZKMQHQBD-UHFFFAOYSA-N
XLogP1.01
TPSA64.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl indazole-1-carboxylate?
The IUPAC name of 2-hydroxyethyl indazole-1-carboxylate (CID 141178752) is 2-hydroxyethyl indazole-1-carboxylate.
What is the SMILES notation for 2-hydroxyethyl indazole-1-carboxylate?
The canonical SMILES for 2-hydroxyethyl indazole-1-carboxylate is O=C(OCCO)n1ncc2ccccc21.
What is the InChIKey of 2-hydroxyethyl indazole-1-carboxylate?
The InChIKey is ASQFQHZKMQHQBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O3/c13-5-6-15-10(14)12-9-4-2-1-3-8(9)7-11-12/h1-4,7,13H,5-6H2.
What are the key properties of 2-hydroxyethyl indazole-1-carboxylate?
2-hydroxyethyl indazole-1-carboxylate has a molecular weight of 206.20 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl indazole-1-carboxylate is sourced from PubChem (CID 141178752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).