N,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide

C8H13N5 — CID 6825223

IUPACN,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide
SMILESCc1ccc(NN=CN(C)C)nn1
InChIInChI=1S/C8H13N5/c1-7-4-5-8(12-10-7)11-9-6-13(2)3/h4-6H,1-3H3,(H,11,12)
InChIKeyHRPZTQPOHSFHAA-UHFFFAOYSA-N
MW179.23 g/mol
LogP0.70
Rot. Bonds3

About N,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide

N,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide (PubChem CID 6825223) has the molecular formula C8H13N5 and a molecular weight of 179.23 g/mol. Its IUPAC name is N,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide.

Molecular Properties

Compound NameN,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide
PubChem CID6825223
Molecular FormulaC8H13N5
Molecular Weight179.23 g/mol
Exact Mass179.12
IUPAC NameN,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide
SMILESCc1ccc(NN=CN(C)C)nn1
InChIInChI=1S/C8H13N5/c1-7-4-5-8(12-10-7)11-9-6-13(2)3/h4-6H,1-3H3,(H,11,12)
InChIKeyHRPZTQPOHSFHAA-UHFFFAOYSA-N
XLogP0.70
TPSA53.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.23
LogP ≤ 50.70
H-Bond Donors ≤ 51
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': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(6-methylpyridazin-3-yl)hydroxylamine
CID 135697316
N,6-dimethylpyridazin-3-amine;ethane
CID 156845540
1-methyl-2-(6-methylpyridazin-3-yl)hydrazine
CID 89270972
N',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine
CID 61313304
N,6-dimethyl-N-(6-methylpyridazin-3-yl)pyridazin-3-amine
CID 142040972
N'-cyclohexyl-N'-methyl-N-(6-methylpyridazin-3-yl)propane-1,3-diamine
CID 61313714
2-chloro-N-(6-methylpyridazin-3-yl)acetamide
CID 166407156
1-N-methyl-4-N-(6-methylpyridazin-3-yl)cyclohexane-1,4-diamine
CID 79111022
6-methyl-N-[1-(4-methylphenyl)ethyl]pyridazin-3-amine
CID 54968124
6-methyl-N-pentan-2-ylpyridazin-3-amine
CID 61313507
N-(3-imidazol-1-ylpropyl)-6-methylpyridazin-3-amine
CID 61313104
N-[(E)-benzylideneamino]-6-methoxypyridazin-3-amine
CID 139215659

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide?
The IUPAC name of N,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide (CID 6825223) is N,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide.
What is the SMILES notation for N,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide?
The canonical SMILES for N,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide is Cc1ccc(NN=CN(C)C)nn1.
What is the InChIKey of N,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide?
The InChIKey is HRPZTQPOHSFHAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5/c1-7-4-5-8(12-10-7)11-9-6-13(2)3/h4-6H,1-3H3,(H,11,12).
What are the key properties of N,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide?
N,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide has a molecular weight of 179.23 g/mol, XLogP of 0.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-N'-[(6-methylpyridazin-3-yl)amino]methanimidamide is sourced from PubChem (CID 6825223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).