N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide

C12H21N5O — CID 79207474

IUPACN-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NCCN(C)C(C)C)nn1
InChIInChI=1S/C12H21N5O/c1-9(2)17(4)8-7-14-11-6-5-10(15-16-11)12(18)13-3/h5-6,9H,7-8H2,1-4H3,(H,13,18)(H,14,16)
InChIKeyZNIFVNFJIHMSNQ-UHFFFAOYSA-N
MW251.33 g/mol
LogP0.59
Rot. Bonds6

About N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide

N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide (PubChem CID 79207474) has the molecular formula C12H21N5O and a molecular weight of 251.33 g/mol. Its IUPAC name is N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide
PubChem CID79207474
Molecular FormulaC12H21N5O
Molecular Weight251.33 g/mol
Exact Mass251.17
IUPAC NameN-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NCCN(C)C(C)C)nn1
InChIInChI=1S/C12H21N5O/c1-9(2)17(4)8-7-14-11-6-5-10(15-16-11)12(18)13-3/h5-6,9H,7-8H2,1-4H3,(H,13,18)(H,14,16)
InChIKeyZNIFVNFJIHMSNQ-UHFFFAOYSA-N
XLogP0.59
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide 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

N-methyl-6-[3-[methyl(propan-2-yl)amino]propylamino]pyridazine-3-carboxamide
CID 103718413
6-[2-[ethyl(methyl)amino]ethylamino]-N-methylpyridazine-3-carboxamide
CID 79207290
6-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridazine-3-carboxamide
CID 106050253
6-[4-(dimethylamino)butylamino]-N-methylpyridazine-3-carboxamide
CID 79207291
6-[2-(2-methoxyethoxy)ethylamino]-N-methylpyridazine-3-carboxamide
CID 79207000
6-[(5-hydroxy-4-methylpentyl)amino]-N-methylpyridazine-3-carboxamide
CID 103858516
6-[2-(dimethylamino)ethylamino]-N-(2-methylpropyl)pyridazine-3-carboxamide
CID 109111165
N-[2-(dimethylamino)ethyl]-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide
CID 109115146
6-(4-hydroxybutylamino)-N-methylpyridazine-3-carboxamide
CID 106842680
6-[[3-(diethylamino)-3-oxopropyl]amino]-N-methylpyridazine-3-carboxamide
CID 79207468
6-[[4-(dimethylamino)-3,3-dimethylbutan-2-yl]amino]-N-methylpyridazine-3-carboxamide
CID 133349282
6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridine-3-carboxamide
CID 79830819

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide?
The IUPAC name of N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide (CID 79207474) is N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide.
What is the SMILES notation for N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide?
The canonical SMILES for N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide is CNC(=O)c1ccc(NCCN(C)C(C)C)nn1.
What is the InChIKey of N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide?
The InChIKey is ZNIFVNFJIHMSNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O/c1-9(2)17(4)8-7-14-11-6-5-10(15-16-11)12(18)13-3/h5-6,9H,7-8H2,1-4H3,(H,13,18)(H,14,16).
What are the key properties of N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide?
N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide has a molecular weight of 251.33 g/mol, XLogP of 0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridazine-3-carboxamide is sourced from PubChem (CID 79207474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).