N-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide

C9H15N5O2 — CID 6410531

IUPACN-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide
SMILESCC(O)CN(C)c1ccc(NNC=O)nn1
InChIInChI=1S/C9H15N5O2/c1-7(16)5-14(2)9-4-3-8(12-13-9)11-10-6-15/h3-4,6-7,16H,5H2,1-2H3,(H,10,15)(H,11,12)
InChIKeyZYGATCKRQMHWAP-UHFFFAOYSA-N
MW225.25 g/mol
LogP-0.63
Rot. Bonds6

About N-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide

N-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide (PubChem CID 6410531) has the molecular formula C9H15N5O2 and a molecular weight of 225.25 g/mol. Its IUPAC name is N-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide.

Molecular Properties

Compound NameN-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide
PubChem CID6410531
Molecular FormulaC9H15N5O2
Molecular Weight225.25 g/mol
Exact Mass225.12
IUPAC NameN-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide
SMILESCC(O)CN(C)c1ccc(NNC=O)nn1
InChIInChI=1S/C9H15N5O2/c1-7(16)5-14(2)9-4-3-8(12-13-9)11-10-6-15/h3-4,6-7,16H,5H2,1-2H3,(H,10,15)(H,11,12)
InChIKeyZYGATCKRQMHWAP-UHFFFAOYSA-N
XLogP-0.63
TPSA90.38 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-0.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide 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-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide?
The IUPAC name of N-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide (CID 6410531) is N-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide.
What is the SMILES notation for N-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide?
The canonical SMILES for N-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide is CC(O)CN(C)c1ccc(NNC=O)nn1.
What is the InChIKey of N-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide?
The InChIKey is ZYGATCKRQMHWAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5O2/c1-7(16)5-14(2)9-4-3-8(12-13-9)11-10-6-15/h3-4,6-7,16H,5H2,1-2H3,(H,10,15)(H,11,12).
What are the key properties of N-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide?
N-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide has a molecular weight of 225.25 g/mol, XLogP of -0.63, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-[2-hydroxypropyl(methyl)amino]pyridazin-3-yl]amino]formamide is sourced from PubChem (CID 6410531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).