6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide

C13H10N6O — CID 121114046

IUPAC6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide
SMILESO=C(Nc1cccnc1)c1ccc(-n2ccnc2)nn1
InChIInChI=1S/C13H10N6O/c20-13(16-10-2-1-5-14-8-10)11-3-4-12(18-17-11)19-7-6-15-9-19/h1-9H,(H,16,20)
InChIKeyUXBQNJFUGARPSD-UHFFFAOYSA-N
MW266.26 g/mol
LogP1.31
Rot. Bonds3

About 6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide

6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide (PubChem CID 121114046) has the molecular formula C13H10N6O and a molecular weight of 266.26 g/mol. Its IUPAC name is 6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide
PubChem CID121114046
Molecular FormulaC13H10N6O
Molecular Weight266.26 g/mol
Exact Mass266.09
IUPAC Name6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide
SMILESO=C(Nc1cccnc1)c1ccc(-n2ccnc2)nn1
InChIInChI=1S/C13H10N6O/c20-13(16-10-2-1-5-14-8-10)11-3-4-12(18-17-11)19-7-6-15-9-19/h1-9H,(H,16,20)
InChIKeyUXBQNJFUGARPSD-UHFFFAOYSA-N
XLogP1.31
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide?
The IUPAC name of 6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide (CID 121114046) is 6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide.
What is the SMILES notation for 6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide?
The canonical SMILES for 6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide is O=C(Nc1cccnc1)c1ccc(-n2ccnc2)nn1.
What is the InChIKey of 6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide?
The InChIKey is UXBQNJFUGARPSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N6O/c20-13(16-10-2-1-5-14-8-10)11-3-4-12(18-17-11)19-7-6-15-9-19/h1-9H,(H,16,20).
What are the key properties of 6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide?
6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide has a molecular weight of 266.26 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide is sourced from PubChem (CID 121114046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).