N-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide

C15H18ClN5O — CID 109115247

IUPACN-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide
SMILESCN(C)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)nn1
InChIInChI=1S/C15H18ClN5O/c1-21(2)9-8-17-14-7-6-13(19-20-14)15(22)18-12-5-3-4-11(16)10-12/h3-7,10H,8-9H2,1-2H3,(H,17,20)(H,18,22)
InChIKeyNOGKJCHIDUHDMR-UHFFFAOYSA-N
MW319.80 g/mol
LogP2.36
Rot. Bonds6

About N-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide

N-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide (PubChem CID 109115247) has the molecular formula C15H18ClN5O and a molecular weight of 319.80 g/mol. Its IUPAC name is N-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide
PubChem CID109115247
Molecular FormulaC15H18ClN5O
Molecular Weight319.80 g/mol
Exact Mass319.12
IUPAC NameN-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide
SMILESCN(C)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)nn1
InChIInChI=1S/C15H18ClN5O/c1-21(2)9-8-17-14-7-6-13(19-20-14)15(22)18-12-5-3-4-11(16)10-12/h3-7,10H,8-9H2,1-2H3,(H,17,20)(H,18,22)
InChIKeyNOGKJCHIDUHDMR-UHFFFAOYSA-N
XLogP2.36
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.80
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,4-difluorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide
CID 109115325
N-(3-chlorophenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridazine-3-carboxamide
CID 109122239
N-(3-chlorophenyl)-6-[2-(3-methoxyphenyl)ethylamino]pyridazine-3-carboxamide
CID 109122361
N-(3-chlorophenyl)-2-[2-(dimethylamino)ethylamino]-6-methylpyrimidine-4-carboxamide
CID 109324937
N-[2-(dimethylamino)ethyl]-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide
CID 109115146
N-(3-acetamidophenyl)-6-(3-chloroanilino)pyridazine-3-carboxamide
CID 109128669
4-chloro-N-[6-[2-(dimethylamino)ethylamino]pyridazin-3-yl]benzamide
CID 113039930
N-tert-butyl-6-[2-(3-chlorophenyl)ethylamino]pyridazine-3-carboxamide
CID 109124842
N-(2-bromo-4-methylphenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide
CID 109115295
N-(3,5-dichlorophenyl)-6-(ethylamino)pyridazine-3-carboxamide
CID 62173126
6-[2-(dimethylamino)ethylamino]-N-(2-methylpropyl)pyridazine-3-carboxamide
CID 109111165
6-[4-(dimethylamino)butylamino]-N-methylpyridazine-3-carboxamide
CID 79207291

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide (CID 109115247) is N-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide is CN(C)CCNc1ccc(C(=O)Nc2cccc(Cl)c2)nn1.
What is the InChIKey of N-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide?
The InChIKey is NOGKJCHIDUHDMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN5O/c1-21(2)9-8-17-14-7-6-13(19-20-14)15(22)18-12-5-3-4-11(16)10-12/h3-7,10H,8-9H2,1-2H3,(H,17,20)(H,18,22).
What are the key properties of N-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide?
N-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide has a molecular weight of 319.80 g/mol, XLogP of 2.36, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide is sourced from PubChem (CID 109115247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).