N-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide

C12H10Br2N4O — CID 107603307

IUPACN-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide
SMILESCNc1ccc(C(=O)Nc2c(Br)cccc2Br)nn1
InChIInChI=1S/C12H10Br2N4O/c1-15-10-6-5-9(17-18-10)12(19)16-11-7(13)3-2-4-8(11)14/h2-6H,1H3,(H,15,18)(H,16,19)
InChIKeyCRAUJIWALIUMJK-UHFFFAOYSA-N
MW386.05 g/mol
LogP3.30
Rot. Bonds3

About N-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide

N-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide (PubChem CID 107603307) has the molecular formula C12H10Br2N4O and a molecular weight of 386.05 g/mol. Its IUPAC name is N-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide
PubChem CID107603307
Molecular FormulaC12H10Br2N4O
Molecular Weight386.05 g/mol
Exact Mass383.92
IUPAC NameN-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide
SMILESCNc1ccc(C(=O)Nc2c(Br)cccc2Br)nn1
InChIInChI=1S/C12H10Br2N4O/c1-15-10-6-5-9(17-18-10)12(19)16-11-7(13)3-2-4-8(11)14/h2-6H,1H3,(H,15,18)(H,16,19)
InChIKeyCRAUJIWALIUMJK-UHFFFAOYSA-N
XLogP3.30
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.05
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-bromo-4,6-difluorophenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 62167720
N-(2-bromo-3-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 103481373
N-(5-bromo-6-methyl-2-pyridinyl)-6-(methylamino)pyridazine-3-carboxamide
CID 79048080
N-(4-bromo-3-fluorophenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 65435257
N-(5-bromo-4-methyl-2-pyridinyl)-6-(methylamino)pyridazine-3-carboxamide
CID 79729705
N-(2-bromo-5-chloro-4-methylphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 104725169
6-(methylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 62165036
N-(4-bromo-2-chlorophenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 62167689
N-(4-bromo-3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 82860303
N-(2-ethylphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 55042896
N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 55042566
N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide
CID 62173045

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide?
The IUPAC name of N-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide (CID 107603307) is N-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide is CNc1ccc(C(=O)Nc2c(Br)cccc2Br)nn1.
What is the InChIKey of N-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide?
The InChIKey is CRAUJIWALIUMJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Br2N4O/c1-15-10-6-5-9(17-18-10)12(19)16-11-7(13)3-2-4-8(11)14/h2-6H,1H3,(H,15,18)(H,16,19).
What are the key properties of N-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide?
N-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide has a molecular weight of 386.05 g/mol, XLogP of 3.30, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dibromophenyl)-6-(methylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 107603307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).