6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide

C15H15N7O2 — CID 87018833

IUPAC6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide
SMILESCCCn1nc(C(=O)Nc2n[nH]c(-c3ccccn3)n2)ccc1=O
InChIInChI=1S/C15H15N7O2/c1-2-9-22-12(23)7-6-11(21-22)14(24)18-15-17-13(19-20-15)10-5-3-4-8-16-10/h3-8H,2,9H2,1H3,(H2,17,18,19,20,24)
InChIKeyJDQLELBHKHKSBK-UHFFFAOYSA-N
MW325.33 g/mol
LogP1.09
Rot. Bonds5

About 6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide

6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide (PubChem CID 87018833) has the molecular formula C15H15N7O2 and a molecular weight of 325.33 g/mol. Its IUPAC name is 6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide
PubChem CID87018833
Molecular FormulaC15H15N7O2
Molecular Weight325.33 g/mol
Exact Mass325.13
IUPAC Name6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide
SMILESCCCn1nc(C(=O)Nc2n[nH]c(-c3ccccn3)n2)ccc1=O
InChIInChI=1S/C15H15N7O2/c1-2-9-22-12(23)7-6-11(21-22)14(24)18-15-17-13(19-20-15)10-5-3-4-8-16-10/h3-8H,2,9H2,1H3,(H2,17,18,19,20,24)
InChIKeyJDQLELBHKHKSBK-UHFFFAOYSA-N
XLogP1.09
TPSA118.45 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.33
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

N-(5-methyl-1H-1,2,4-triazol-3-yl)-6-oxo-1-propylpyridazine-3-carboxamide
CID 78927502
3-methylsulfonyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;molecular hydrogen;6-oxo-1-(2-phenoxyethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide
CID 142506593
2-methyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pentanamide
CID 154748583
1-(2-methoxyethyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)-6-oxopyridazine-3-carboxamide
CID 78927868
4-methyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide
CID 86992065
N-(4,5-dimethyl-1H-pyrazol-3-yl)-6-oxo-1-propylpyridazine-3-carboxamide
CID 86812037
6-oxo-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]-1-propylpyridazine-3-carboxamide
CID 30729881
2-phenylsulfanyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide
CID 87018830
1-butyl-N-(2-hydroxyphenyl)-6-oxopyridazine-3-carboxamide
CID 25474489
N-[4-oxo-4-[(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)amino]butan-2-yl]benzamide
CID 86992038
6-oxo-N-[4-(4-phenylpiperazin-1-yl)butyl]-1-propylpyridazine-3-carboxamide
CID 55859833
4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide
CID 167849051

Frequently Asked Questions

What is the IUPAC name of 6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide?
The IUPAC name of 6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide (CID 87018833) is 6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide?
The canonical SMILES for 6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide is CCCn1nc(C(=O)Nc2n[nH]c(-c3ccccn3)n2)ccc1=O.
What is the InChIKey of 6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide?
The InChIKey is JDQLELBHKHKSBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N7O2/c1-2-9-22-12(23)7-6-11(21-22)14(24)18-15-17-13(19-20-15)10-5-3-4-8-16-10/h3-8H,2,9H2,1H3,(H2,17,18,19,20,24).
What are the key properties of 6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide?
6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide has a molecular weight of 325.33 g/mol, XLogP of 1.09, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-1-propyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 87018833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).