N'-hydroxy-2-indazol-1-ylethanimidamide

C9H10N4O — CID 62140562

IUPACN'-hydroxy-2-indazol-1-ylethanimidamide
SMILESN/C(Cn1ncc2ccccc21)=N\O
InChIInChI=1S/C9H10N4O/c10-9(12-14)6-13-8-4-2-1-3-7(8)5-11-13/h1-5,14H,6H2,(H2,10,12)
InChIKeyHHMCDJLWSLXXOQ-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.78
Rot. Bonds2

About N'-hydroxy-2-indazol-1-ylethanimidamide

N'-hydroxy-2-indazol-1-ylethanimidamide (PubChem CID 62140562) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is N'-hydroxy-2-indazol-1-ylethanimidamide.

Molecular Properties

Compound NameN'-hydroxy-2-indazol-1-ylethanimidamide
PubChem CID62140562
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC NameN'-hydroxy-2-indazol-1-ylethanimidamide
SMILESN/C(Cn1ncc2ccccc21)=N\O
InChIInChI=1S/C9H10N4O/c10-9(12-14)6-13-8-4-2-1-3-7(8)5-11-13/h1-5,14H,6H2,(H2,10,12)
InChIKeyHHMCDJLWSLXXOQ-UHFFFAOYSA-N
XLogP0.78
TPSA76.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Indanidine
CID 121925
2-Methyl-2H-indazol-6-amine
CID 590220
1-benzyl-1H-indazole
CID 797066
(2S)-1-(6-fluoroindazol-1-yl)propan-2-amine
CID 9859429
1-Methyl-1H-indazole
CID 139456
1-methyl-1H-indazol-5-amine
CID 2768032
(S)-1-(5-Fluoro-1H-indazol-1-yl)propan-2-amine
CID 44452853
1-Phenyl-1H-indazole
CID 304268
N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-(1-methylpyrazol-3-yl)aniline
CID 9816515
N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-(2-methylpyrazol-3-yl)aniline
CID 9837963
N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-(2-ethylpyrazol-3-yl)aniline
CID 9838294
N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-(1-ethylpyrazol-3-yl)aniline
CID 10221066

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-2-indazol-1-ylethanimidamide?
The IUPAC name of N'-hydroxy-2-indazol-1-ylethanimidamide (CID 62140562) is N'-hydroxy-2-indazol-1-ylethanimidamide.
What is the SMILES notation for N'-hydroxy-2-indazol-1-ylethanimidamide?
The canonical SMILES for N'-hydroxy-2-indazol-1-ylethanimidamide is N/C(Cn1ncc2ccccc21)=N\O.
What is the InChIKey of N'-hydroxy-2-indazol-1-ylethanimidamide?
The InChIKey is HHMCDJLWSLXXOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c10-9(12-14)6-13-8-4-2-1-3-7(8)5-11-13/h1-5,14H,6H2,(H2,10,12).
What are the key properties of N'-hydroxy-2-indazol-1-ylethanimidamide?
N'-hydroxy-2-indazol-1-ylethanimidamide has a molecular weight of 190.21 g/mol, XLogP of 0.78, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-2-indazol-1-ylethanimidamide is sourced from PubChem (CID 62140562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).