N-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide

C10H10N4O3 — CID 112674427

IUPACN-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide
SMILESNC(=O)CONC(=O)c1ccc2cn[nH]c2c1
InChIInChI=1S/C10H10N4O3/c11-9(15)5-17-14-10(16)6-1-2-7-4-12-13-8(7)3-6/h1-4H,5H2,(H2,11,15)(H,12,13)(H,14,16)
InChIKeyIVIOFFHJGPPGSH-UHFFFAOYSA-N
MW234.22 g/mol
LogP-0.29
Rot. Bonds4

About N-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide

N-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide (PubChem CID 112674427) has the molecular formula C10H10N4O3 and a molecular weight of 234.22 g/mol. Its IUPAC name is N-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide
PubChem CID112674427
Molecular FormulaC10H10N4O3
Molecular Weight234.22 g/mol
Exact Mass234.08
IUPAC NameN-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide
SMILESNC(=O)CONC(=O)c1ccc2cn[nH]c2c1
InChIInChI=1S/C10H10N4O3/c11-9(15)5-17-14-10(16)6-1-2-7-4-12-13-8(7)3-6/h1-4H,5H2,(H2,11,15)(H,12,13)(H,14,16)
InChIKeyIVIOFFHJGPPGSH-UHFFFAOYSA-N
XLogP-0.29
TPSA110.10 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide (CID 112674427) is N-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide is NC(=O)CONC(=O)c1ccc2cn[nH]c2c1.
What is the InChIKey of N-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide?
The InChIKey is IVIOFFHJGPPGSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O3/c11-9(15)5-17-14-10(16)6-1-2-7-4-12-13-8(7)3-6/h1-4H,5H2,(H2,11,15)(H,12,13)(H,14,16).
What are the key properties of N-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide?
N-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide has a molecular weight of 234.22 g/mol, XLogP of -0.29, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide is sourced from PubChem (CID 112674427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).