3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide

C12H9Cl2N3O2 — CID 6401431

IUPAC3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide
SMILESCOc1ccccc1NC(=O)c1cc(Cl)nnc1Cl
InChIInChI=1S/C12H9Cl2N3O2/c1-19-9-5-3-2-4-8(9)15-12(18)7-6-10(13)16-17-11(7)14/h2-6H,1H3,(H,15,18)
InChIKeyRGFWHRXRCDUWIP-UHFFFAOYSA-N
MW298.13 g/mol
LogP3.04
Rot. Bonds3

About 3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide

3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide (PubChem CID 6401431) has the molecular formula C12H9Cl2N3O2 and a molecular weight of 298.13 g/mol. Its IUPAC name is 3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide.

Molecular Properties

Compound Name3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide
PubChem CID6401431
Molecular FormulaC12H9Cl2N3O2
Molecular Weight298.13 g/mol
Exact Mass297.01
IUPAC Name3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide
SMILESCOc1ccccc1NC(=O)c1cc(Cl)nnc1Cl
InChIInChI=1S/C12H9Cl2N3O2/c1-19-9-5-3-2-4-8(9)15-12(18)7-6-10(13)16-17-11(7)14/h2-6H,1H3,(H,15,18)
InChIKeyRGFWHRXRCDUWIP-UHFFFAOYSA-N
XLogP3.04
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.13
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide?
The IUPAC name of 3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide (CID 6401431) is 3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide.
What is the SMILES notation for 3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide?
The canonical SMILES for 3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide is COc1ccccc1NC(=O)c1cc(Cl)nnc1Cl.
What is the InChIKey of 3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide?
The InChIKey is RGFWHRXRCDUWIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2N3O2/c1-19-9-5-3-2-4-8(9)15-12(18)7-6-10(13)16-17-11(7)14/h2-6H,1H3,(H,15,18).
What are the key properties of 3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide?
3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide has a molecular weight of 298.13 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dichloro-N-(2-methoxyphenyl)pyridazine-4-carboxamide is sourced from PubChem (CID 6401431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).