N-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide

C6H10N4O — CID 10606977

IUPACN-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide
SMILESC/C(=N/c1[nH]ncc1C)NO
InChIInChI=1S/C6H10N4O/c1-4-3-7-9-6(4)8-5(2)10-11/h3,11H,1-2H3,(H2,7,8,9,10)
InChIKeyBOQVRWOHQYZPQH-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.75
Rot. Bonds1

About N-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide

N-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide (PubChem CID 10606977) has the molecular formula C6H10N4O and a molecular weight of 154.17 g/mol. Its IUPAC name is N-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide.

Molecular Properties

Compound NameN-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide
PubChem CID10606977
Molecular FormulaC6H10N4O
Molecular Weight154.17 g/mol
Exact Mass154.09
IUPAC NameN-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide
SMILESC/C(=N/c1[nH]ncc1C)NO
InChIInChI=1S/C6H10N4O/c1-4-3-7-9-6(4)8-5(2)10-11/h3,11H,1-2H3,(H2,7,8,9,10)
InChIKeyBOQVRWOHQYZPQH-UHFFFAOYSA-N
XLogP0.75
TPSA73.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide?
The IUPAC name of N-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide (CID 10606977) is N-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide.
What is the SMILES notation for N-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide?
The canonical SMILES for N-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide is C/C(=N/c1[nH]ncc1C)NO.
What is the InChIKey of N-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide?
The InChIKey is BOQVRWOHQYZPQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O/c1-4-3-7-9-6(4)8-5(2)10-11/h3,11H,1-2H3,(H2,7,8,9,10).
What are the key properties of N-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide?
N-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide has a molecular weight of 154.17 g/mol, XLogP of 0.75, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N'-(4-methyl-1H-pyrazol-5-yl)ethanimidamide is sourced from PubChem (CID 10606977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).