N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide

C12H10BrClN4O — CID 62167689

IUPACN-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide
SMILESCNc1ccc(C(=O)Nc2ccc(Br)cc2Cl)nn1
InChIInChI=1S/C12H10BrClN4O/c1-15-11-5-4-10(17-18-11)12(19)16-9-3-2-7(13)6-8(9)14/h2-6H,1H3,(H,15,18)(H,16,19)
InChIKeyICYZYVPFGQDHOA-UHFFFAOYSA-N
MW341.60 g/mol
LogP3.19
Rot. Bonds3

About N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide

N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide (PubChem CID 62167689) has the molecular formula C12H10BrClN4O and a molecular weight of 341.60 g/mol. Its IUPAC name is N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide
PubChem CID62167689
Molecular FormulaC12H10BrClN4O
Molecular Weight341.60 g/mol
Exact Mass339.97
IUPAC NameN-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide
SMILESCNc1ccc(C(=O)Nc2ccc(Br)cc2Cl)nn1
InChIInChI=1S/C12H10BrClN4O/c1-15-11-5-4-10(17-18-11)12(19)16-9-3-2-7(13)6-8(9)14/h2-6H,1H3,(H,15,18)(H,16,19)
InChIKeyICYZYVPFGQDHOA-UHFFFAOYSA-N
XLogP3.19
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.60
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-bromo-2-chlorophenyl)-6-(methylamino)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-(4-bromo-2-chlorophenyl)-5-chloro-2-(methylamino)pyridine-4-carboxamide
CID 114922117
N-(2-bromo-5-chloro-4-methylphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 104725169
N-(2-bromo-3-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 103481373
(4-bromo-2-chlorophenyl)urea
CID 60759349
5-bromo-N-(4-bromo-2-chlorophenyl)-2-(methylamino)pyridine-3-carboxamide
CID 62167546
N-(4-bromo-2-methylphenyl)-6-(ethylamino)pyridazine-3-carboxamide
CID 62186794
4-bromo-2-chloro-N-(2-chloro-4-methylphenyl)benzamide
CID 47299820
N-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 107603307
1-(4-bromo-2-chlorophenyl)-3-methylurea
CID 21161446
4-bromo-N-(4-bromo-2-chlorophenyl)benzamide
CID 7924398
N-(2-chloro-4-iodophenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 107606112
6-anilino-N-(4-bromo-2-methylphenyl)pyridazine-3-carboxamide
CID 109126617

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide?
The IUPAC name of N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide (CID 62167689) is N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide is CNc1ccc(C(=O)Nc2ccc(Br)cc2Cl)nn1.
What is the InChIKey of N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide?
The InChIKey is ICYZYVPFGQDHOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrClN4O/c1-15-11-5-4-10(17-18-11)12(19)16-9-3-2-7(13)6-8(9)14/h2-6H,1H3,(H,15,18)(H,16,19).
What are the key properties of N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide?
N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide has a molecular weight of 341.60 g/mol, XLogP of 3.19, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 62167689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).