N-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide

C13H10N6O — CID 45256977

IUPACN-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESO=C(Nc1ccnnc1)c1cnn(-c2ccccn2)c1
InChIInChI=1S/C13H10N6O/c20-13(18-11-4-6-15-16-8-11)10-7-17-19(9-10)12-3-1-2-5-14-12/h1-9H,(H,15,18,20)
InChIKeyATAVTVSLWFHPSV-UHFFFAOYSA-N
MW266.26 g/mol
LogP1.31
Rot. Bonds3

About N-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide

N-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide (PubChem CID 45256977) has the molecular formula C13H10N6O and a molecular weight of 266.26 g/mol. Its IUPAC name is N-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide
PubChem CID45256977
Molecular FormulaC13H10N6O
Molecular Weight266.26 g/mol
Exact Mass266.09
IUPAC NameN-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESO=C(Nc1ccnnc1)c1cnn(-c2ccccn2)c1
InChIInChI=1S/C13H10N6O/c20-13(18-11-4-6-15-16-8-11)10-7-17-19(9-10)12-3-1-2-5-14-12/h1-9H,(H,15,18,20)
InChIKeyATAVTVSLWFHPSV-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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Related Compounds

1-pyridin-2-ylpyrazole-4-carbonyl chloride
CID 83814309
5-(difluoromethyl)-N-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 45256976
3-hydroxy-N-(1-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide
CID 75510958
1-(2-methylpropyl)-N-pyridazin-4-ylpyrazole-4-carboxamide
CID 45255887
1-methyl-N-(1-pyridin-2-ylpyrazol-4-yl)triazole-4-carboxamide
CID 110471594
1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide
CID 171981866
methyl 5-(1-methylpyrazol-4-yl)-3-[(1-pyridin-2-ylpyrazole-4-carbonyl)amino]thiophene-2-carboxylate
CID 167984624
1-(2-chlorophenyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)pyrazole-4-carboxamide
CID 49193462
2-amino-N-(1-pyridin-2-ylpyrazol-4-yl)-5-(trifluoromethyl)benzamide
CID 118427664
1-benzyl-3-N-methyl-2-oxo-5-N-pyridazin-4-ylpyridine-3,5-dicarboxamide
CID 135341776
N-[4-(aminomethyl)phenyl]-1-(4-methyl-2-pyridinyl)pyrazole-4-carboxamide
CID 166363312
1-(2,4-dichlorophenyl)-N-pyridin-2-ylpyrazole-4-carboxamide
CID 68934305

Frequently Asked Questions

What is the IUPAC name of N-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide?
The IUPAC name of N-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide (CID 45256977) is N-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for N-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide?
The canonical SMILES for N-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide is O=C(Nc1ccnnc1)c1cnn(-c2ccccn2)c1.
What is the InChIKey of N-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide?
The InChIKey is ATAVTVSLWFHPSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N6O/c20-13(18-11-4-6-15-16-8-11)10-7-17-19(9-10)12-3-1-2-5-14-12/h1-9H,(H,15,18,20).
What are the key properties of N-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide?
N-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-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 N-pyridazin-4-yl-1-pyridin-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 45256977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).