N-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide

C14H14Cl2N4O — CID 104728134

IUPACN-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide
SMILESCCNc1ccc(C(=O)Nc2cc(Cl)c(C)cc2Cl)nn1
InChIInChI=1S/C14H14Cl2N4O/c1-3-17-13-5-4-11(19-20-13)14(21)18-12-7-9(15)8(2)6-10(12)16/h4-7H,3H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyPRJVGIGJEYEDFC-UHFFFAOYSA-N
MW325.20 g/mol
LogP3.78
Rot. Bonds4

About N-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide

N-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide (PubChem CID 104728134) has the molecular formula C14H14Cl2N4O and a molecular weight of 325.20 g/mol. Its IUPAC name is N-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide
PubChem CID104728134
Molecular FormulaC14H14Cl2N4O
Molecular Weight325.20 g/mol
Exact Mass324.05
IUPAC NameN-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide
SMILESCCNc1ccc(C(=O)Nc2cc(Cl)c(C)cc2Cl)nn1
InChIInChI=1S/C14H14Cl2N4O/c1-3-17-13-5-4-11(19-20-13)14(21)18-12-7-9(15)8(2)6-10(12)16/h4-7H,3H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyPRJVGIGJEYEDFC-UHFFFAOYSA-N
XLogP3.78
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.20
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-bromo-2-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide
CID 62186794
N-(2,3-dimethylphenyl)-6-(ethylamino)pyridazine-3-carboxamide
CID 62166086
N-(3,5-dichlorophenyl)-6-(ethylamino)pyridazine-3-carboxamide
CID 62173126
N-(4-bromo-2,6-dichlorophenyl)-6-(ethylamino)pyridazine-3-carboxamide
CID 62167008
6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridazine-3-carboxamide
CID 79044361
N-(2-bromo-5-chloro-4-methylphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 104725169
N-(4-bromo-2,3-dichlorophenyl)-6-(ethylamino)pyridazine-3-carboxamide
CID 107793423
6-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridazine-3-carboxamide
CID 62166237
6-(butylamino)-N-(2,5-dichlorophenyl)pyridazine-3-carboxamide
CID 109110754
6-[(2-chlorophenyl)methylamino]-N-(2-methylphenyl)pyridazine-3-carboxamide
CID 109119670
N-(4-chloro-2-methoxy-5-methylphenyl)-6-[(3-methylphenyl)methylamino]pyridazine-3-carboxamide
CID 109118337
6-(ethylamino)-N-(1-methylpyrazol-3-yl)pyridazine-3-carboxamide
CID 62180741

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide?
The IUPAC name of N-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide (CID 104728134) is N-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide is CCNc1ccc(C(=O)Nc2cc(Cl)c(C)cc2Cl)nn1.
What is the InChIKey of N-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide?
The InChIKey is PRJVGIGJEYEDFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N4O/c1-3-17-13-5-4-11(19-20-13)14(21)18-12-7-9(15)8(2)6-10(12)16/h4-7H,3H2,1-2H3,(H,17,20)(H,18,21).
What are the key properties of N-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide?
N-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide has a molecular weight of 325.20 g/mol, XLogP of 3.78, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichloro-4-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 104728134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).