2-(5-aminopentyl)-5-methylpyridazin-3-one

C10H17N3O — CID 106548374

IUPAC2-(5-aminopentyl)-5-methylpyridazin-3-one
SMILESCc1cnn(CCCCCN)c(=O)c1
InChIInChI=1S/C10H17N3O/c1-9-7-10(14)13(12-8-9)6-4-2-3-5-11/h7-8H,2-6,11H2,1H3
InChIKeyGFONGRJGMMZNON-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.68
Rot. Bonds5

About 2-(5-aminopentyl)-5-methylpyridazin-3-one

2-(5-aminopentyl)-5-methylpyridazin-3-one (PubChem CID 106548374) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 2-(5-aminopentyl)-5-methylpyridazin-3-one.

Molecular Properties

Compound Name2-(5-aminopentyl)-5-methylpyridazin-3-one
PubChem CID106548374
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name2-(5-aminopentyl)-5-methylpyridazin-3-one
SMILESCc1cnn(CCCCCN)c(=O)c1
InChIInChI=1S/C10H17N3O/c1-9-7-10(14)13(12-8-9)6-4-2-3-5-11/h7-8H,2-6,11H2,1H3
InChIKeyGFONGRJGMMZNON-UHFFFAOYSA-N
XLogP0.68
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(5-aminopentyl)-5-methylpyridazin-3-one with MolForge

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

Launch Full Analysis

Related Compounds

2-(3-Fluorobutyl)-5-methylpyridazin-3-one
CID 131183205
5-(Aminomethyl)-2-ethylpyridazin-3(2H)-one
CID 21066412
2-[2-(Pentylamino)ethyl]pyridazin-3-one
CID 62848748
2-[2-(Hexylamino)ethyl]pyridazin-3-one
CID 62848749
2-[4-(Ethylamino)butyl]pyridazin-3-one
CID 62849448
2-[4-(Propylamino)butyl]pyridazin-3-one
CID 62849624
2-(5-Aminopentyl)pyridazin-3-one
CID 62849770
2-[4-(2-Methylpropylamino)butyl]pyridazin-3-one
CID 62849801
2-[5-(Methylamino)hexyl]pyridazin-3-one
CID 62850670
2-[5-(Ethylamino)hexyl]pyridazin-3-one
CID 62850671
2-[5-(Propylamino)hexyl]pyridazin-3-one
CID 62850672
2-(5-Aminohexyl)pyridazin-3-one
CID 62850673

Frequently Asked Questions

What is the IUPAC name of 2-(5-aminopentyl)-5-methylpyridazin-3-one?
The IUPAC name of 2-(5-aminopentyl)-5-methylpyridazin-3-one (CID 106548374) is 2-(5-aminopentyl)-5-methylpyridazin-3-one.
What is the SMILES notation for 2-(5-aminopentyl)-5-methylpyridazin-3-one?
The canonical SMILES for 2-(5-aminopentyl)-5-methylpyridazin-3-one is Cc1cnn(CCCCCN)c(=O)c1.
What is the InChIKey of 2-(5-aminopentyl)-5-methylpyridazin-3-one?
The InChIKey is GFONGRJGMMZNON-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-9-7-10(14)13(12-8-9)6-4-2-3-5-11/h7-8H,2-6,11H2,1H3.
What are the key properties of 2-(5-aminopentyl)-5-methylpyridazin-3-one?
2-(5-aminopentyl)-5-methylpyridazin-3-one has a molecular weight of 195.27 g/mol, XLogP of 0.68, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-aminopentyl)-5-methylpyridazin-3-one is sourced from PubChem (CID 106548374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).