N-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide

C15H17BrN4O — CID 109111085

IUPACN-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide
SMILESCC(C)CNc1ccc(C(=O)Nc2ccc(Br)cc2)nn1
InChIInChI=1S/C15H17BrN4O/c1-10(2)9-17-14-8-7-13(19-20-14)15(21)18-12-5-3-11(16)4-6-12/h3-8,10H,9H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyZLHQUIMOTJZELM-UHFFFAOYSA-N
MW349.23 g/mol
LogP3.56
Rot. Bonds5

About N-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide

N-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide (PubChem CID 109111085) has the molecular formula C15H17BrN4O and a molecular weight of 349.23 g/mol. Its IUPAC name is N-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide
PubChem CID109111085
Molecular FormulaC15H17BrN4O
Molecular Weight349.23 g/mol
Exact Mass348.06
IUPAC NameN-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide
SMILESCC(C)CNc1ccc(C(=O)Nc2ccc(Br)cc2)nn1
InChIInChI=1S/C15H17BrN4O/c1-10(2)9-17-14-8-7-13(19-20-14)15(21)18-12-5-3-11(16)4-6-12/h3-8,10H,9H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyZLHQUIMOTJZELM-UHFFFAOYSA-N
XLogP3.56
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.23
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-bromophenyl)-6-(2-methylpropylamino)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-bromophenyl)-6-(3-methylbutylamino)pyridazine-3-carboxamide
CID 109125190
6-(2-methylpropylamino)-N-(4-propan-2-ylphenyl)pyridazine-3-carboxamide
CID 109111066
N-(4-ethylphenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide
CID 109111062
N-(4-bromo-3-methylphenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide
CID 109111125
N-(3,4-dimethoxyphenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide
CID 109111097
N-(3-chloro-4-fluorophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide
CID 109111081
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(2-methylpropylamino)pyridazine-3-carboxamide
CID 109111127
N-(3-acetylphenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide
CID 109111101
N-(4-bromophenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 62247763
N-(4-bromophenyl)-4-(2-methylpropylamino)pyridine-2-carboxamide
CID 109203163
N-(4-bromophenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide
CID 109117446
6-(3-methylbutylamino)-N-phenylpyridazine-3-carboxamide
CID 109125155

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide?
The IUPAC name of N-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide (CID 109111085) is N-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide is CC(C)CNc1ccc(C(=O)Nc2ccc(Br)cc2)nn1.
What is the InChIKey of N-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide?
The InChIKey is ZLHQUIMOTJZELM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN4O/c1-10(2)9-17-14-8-7-13(19-20-14)15(21)18-12-5-3-11(16)4-6-12/h3-8,10H,9H2,1-2H3,(H,17,20)(H,18,21).
What are the key properties of N-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide?
N-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide has a molecular weight of 349.23 g/mol, XLogP of 3.56, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-6-(2-methylpropylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 109111085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).