6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide

C12H9N5O — CID 55043296

IUPAC6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1ccc(N)nn1
InChIInChI=1S/C12H9N5O/c13-7-8-3-1-2-4-9(8)15-12(18)10-5-6-11(14)17-16-10/h1-6H,(H2,14,17)(H,15,18)
InChIKeyNXUNWPUPMZNVBE-UHFFFAOYSA-N
MW239.24 g/mol
LogP1.18
Rot. Bonds2

About 6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide

6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide (PubChem CID 55043296) has the molecular formula C12H9N5O and a molecular weight of 239.24 g/mol. Its IUPAC name is 6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide
PubChem CID55043296
Molecular FormulaC12H9N5O
Molecular Weight239.24 g/mol
Exact Mass239.08
IUPAC Name6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1ccc(N)nn1
InChIInChI=1S/C12H9N5O/c13-7-8-3-1-2-4-9(8)15-12(18)10-5-6-11(14)17-16-10/h1-6H,(H2,14,17)(H,15,18)
InChIKeyNXUNWPUPMZNVBE-UHFFFAOYSA-N
XLogP1.18
TPSA104.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.24
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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N-(2-cyanophenyl)thiadiazole-4-carboxamide
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N-(2-cyanophenyl)-6-(4-fluoroanilino)pyridazine-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide (CID 55043296) is 6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide is N#Cc1ccccc1NC(=O)c1ccc(N)nn1.
What is the InChIKey of 6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide?
The InChIKey is NXUNWPUPMZNVBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N5O/c13-7-8-3-1-2-4-9(8)15-12(18)10-5-6-11(14)17-16-10/h1-6H,(H2,14,17)(H,15,18).
What are the key properties of 6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide?
6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide has a molecular weight of 239.24 g/mol, XLogP of 1.18, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 55043296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).