N'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide

C12H19N5O2 — CID 136924818

IUPACN'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide
SMILESCc1nnc(N2CCOCC2C)c(/C(N)=N/O)c1C
InChIInChI=1S/C12H19N5O2/c1-7-6-19-5-4-17(7)12-10(11(13)16-18)8(2)9(3)14-15-12/h7,18H,4-6H2,1-3H3,(H2,13,16)
InChIKeyKNWSOIKHDAGYCE-UHFFFAOYSA-N
MW265.32 g/mol
LogP0.41
Rot. Bonds2

About N'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide

N'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide (PubChem CID 136924818) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is N'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide
PubChem CID136924818
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC NameN'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide
SMILESCc1nnc(N2CCOCC2C)c(/C(N)=N/O)c1C
InChIInChI=1S/C12H19N5O2/c1-7-6-19-5-4-17(7)12-10(11(13)16-18)8(2)9(3)14-15-12/h7,18H,4-6H2,1-3H3,(H2,13,16)
InChIKeyKNWSOIKHDAGYCE-UHFFFAOYSA-N
XLogP0.41
TPSA96.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide 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

3-(2,4-dimethylpyrrolidin-1-yl)-N'-hydroxy-5,6-dimethylpyridazine-4-carboximidamide
CID 136820485
5-bromo-N'-hydroxy-2-(3-methylmorpholin-4-yl)benzenecarboximidamide
CID 114892403
N'-hydroxy-5-[3-(hydroxymethyl)morpholin-4-yl]-1,3-dimethylpyrazole-4-carboximidamide
CID 104877402
(3R)-3-methyl-4-[4-methyl-6-[(3S)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine
CID 155440037
(3R)-3-methyl-4-[4-methyl-6-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine
CID 155439964
3-(1,1-dioxo-1,4-thiazepan-4-yl)-N'-hydroxy-5,6-dimethylpyridazine-4-carboximidamide
CID 136733794
N'-hydroxy-5,6-dimethyl-3-(2-methyloxolan-3-yl)sulfanylpyridazine-4-carboximidamide
CID 136806017
6-methyl-2-(3-methylmorpholin-4-yl)pyridin-3-amine
CID 81131826
2-(3-methylmorpholin-4-yl)pyridine-3-carboxamide
CID 155353856
N'-hydroxy-2-(3-methylmorpholin-4-yl)-5-nitrobenzenecarboximidamide
CID 76935210
4-(4-chlorophthalazin-1-yl)-3-methylmorpholine
CID 62141543
4-(4-chloro-1,2,5-thiadiazol-3-yl)-3-methylmorpholine
CID 43808294

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide?
The IUPAC name of N'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide (CID 136924818) is N'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide.
What is the SMILES notation for N'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide?
The canonical SMILES for N'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide is Cc1nnc(N2CCOCC2C)c(/C(N)=N/O)c1C.
What is the InChIKey of N'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide?
The InChIKey is KNWSOIKHDAGYCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-7-6-19-5-4-17(7)12-10(11(13)16-18)8(2)9(3)14-15-12/h7,18H,4-6H2,1-3H3,(H2,13,16).
What are the key properties of N'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide?
N'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide has a molecular weight of 265.32 g/mol, XLogP of 0.41, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-5,6-dimethyl-3-(3-methylmorpholin-4-yl)pyridazine-4-carboximidamide is sourced from PubChem (CID 136924818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).