N-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine

C11H17N3 — CID 134578096

IUPACN-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine
SMILESC=NN1N=CC=C/C1=C/CCC(C)C
InChIInChI=1S/C11H17N3/c1-10(2)6-4-7-11-8-5-9-13-14(11)12-3/h5,7-10H,3-4,6H2,1-2H3/b11-7-
InChIKeyNPFPIRDFRIMVOV-XFFZJAGNSA-N
MW191.28 g/mol
LogP2.78
Rot. Bonds4

About N-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine

N-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine (PubChem CID 134578096) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is N-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine.

Molecular Properties

Compound NameN-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine
PubChem CID134578096
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC NameN-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine
SMILESC=NN1N=CC=C/C1=C/CCC(C)C
InChIInChI=1S/C11H17N3/c1-10(2)6-4-7-11-8-5-9-13-14(11)12-3/h5,7-10H,3-4,6H2,1-2H3/b11-7-
InChIKeyNPFPIRDFRIMVOV-XFFZJAGNSA-N
XLogP2.78
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze N-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine?
The IUPAC name of N-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine (CID 134578096) is N-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine.
What is the SMILES notation for N-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine?
The canonical SMILES for N-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine is C=NN1N=CC=C/C1=C/CCC(C)C.
What is the InChIKey of N-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine?
The InChIKey is NPFPIRDFRIMVOV-XFFZJAGNSA-N. The full InChI is InChI=1S/C11H17N3/c1-10(2)6-4-7-11-8-5-9-13-14(11)12-3/h5,7-10H,3-4,6H2,1-2H3/b11-7-.
What are the key properties of N-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine?
N-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine has a molecular weight of 191.28 g/mol, XLogP of 2.78, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6Z)-6-(4-methylpentylidene)pyridazin-1-yl]methanimine is sourced from PubChem (CID 134578096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).