N-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide

C7H11N5 — CID 144882860

IUPACN-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide
SMILESCCc1ccc(/N=C/NN)nn1
InChIInChI=1S/C7H11N5/c1-2-6-3-4-7(12-11-6)9-5-10-8/h3-5H,2,8H2,1H3,(H,9,10,12)
InChIKeyIBMIFGGKOVLWEG-UHFFFAOYSA-N
MW165.20 g/mol
LogP0.16
Rot. Bonds3

About N-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide

N-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide (PubChem CID 144882860) has the molecular formula C7H11N5 and a molecular weight of 165.20 g/mol. Its IUPAC name is N-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide.

Molecular Properties

Compound NameN-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide
PubChem CID144882860
Molecular FormulaC7H11N5
Molecular Weight165.20 g/mol
Exact Mass165.10
IUPAC NameN-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide
SMILESCCc1ccc(/N=C/NN)nn1
InChIInChI=1S/C7H11N5/c1-2-6-3-4-7(12-11-6)9-5-10-8/h3-5H,2,8H2,1H3,(H,9,10,12)
InChIKeyIBMIFGGKOVLWEG-UHFFFAOYSA-N
XLogP0.16
TPSA76.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'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-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide?
The IUPAC name of N-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide (CID 144882860) is N-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide.
What is the SMILES notation for N-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide?
The canonical SMILES for N-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide is CCc1ccc(/N=C/NN)nn1.
What is the InChIKey of N-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide?
The InChIKey is IBMIFGGKOVLWEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N5/c1-2-6-3-4-7(12-11-6)9-5-10-8/h3-5H,2,8H2,1H3,(H,9,10,12).
What are the key properties of N-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide?
N-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide has a molecular weight of 165.20 g/mol, XLogP of 0.16, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N'-(6-ethylpyridazin-3-yl)methanimidamide is sourced from PubChem (CID 144882860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).