6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide

C14H13N5O2 — CID 61276124

IUPAC6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide
SMILESO=C1CCC(C(=O)Nc2ccccc2-n2cccn2)=NN1
InChIInChI=1S/C14H13N5O2/c20-13-7-6-11(17-18-13)14(21)16-10-4-1-2-5-12(10)19-9-3-8-15-19/h1-5,8-9H,6-7H2,(H,16,21)(H,18,20)
InChIKeyAILNJIBFXARDHS-UHFFFAOYSA-N
MW283.29 g/mol
LogP1.08
Rot. Bonds3

About 6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide

6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide (PubChem CID 61276124) has the molecular formula C14H13N5O2 and a molecular weight of 283.29 g/mol. Its IUPAC name is 6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide
PubChem CID61276124
Molecular FormulaC14H13N5O2
Molecular Weight283.29 g/mol
Exact Mass283.11
IUPAC Name6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide
SMILESO=C1CCC(C(=O)Nc2ccccc2-n2cccn2)=NN1
InChIInChI=1S/C14H13N5O2/c20-13-7-6-11(17-18-13)14(21)16-10-4-1-2-5-12(10)19-9-3-8-15-19/h1-5,8-9H,6-7H2,(H,16,21)(H,18,20)
InChIKeyAILNJIBFXARDHS-UHFFFAOYSA-N
XLogP1.08
TPSA88.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-oxo-N-(2-pyrazol-1-yl-3-pyridinyl)-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 61258857
N-(2-morpholin-4-ylphenyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 2815283
2-[2-[(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)amino]phenyl]acetic acid
CID 62536488
6-bromo-N-(2-pyrazol-1-ylphenyl)pyridine-2-carboxamide
CID 103874264
6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide
CID 61041740
3-bromo-2,6-dichloro-N-(2-pyrazol-1-ylphenyl)benzamide
CID 132992182
N-[2-(methylsulfamoyl)phenyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 61258347
6-oxo-N-[2-(trifluoromethoxy)phenyl]-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 43402110
2-[2-[(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)amino]phenoxy]acetic acid
CID 63747208
1,1-dimethyl-3-(2-pyrazol-1-ylphenyl)urea
CID 110470431
4-propan-2-yl-N-(2-pyrazol-1-ylphenyl)benzamide
CID 47045211
9-oxo-N-(2-pyrazol-1-ylphenyl)fluorene-1-carboxamide
CID 11696276

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide?
The IUPAC name of 6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide (CID 61276124) is 6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide?
The canonical SMILES for 6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide is O=C1CCC(C(=O)Nc2ccccc2-n2cccn2)=NN1.
What is the InChIKey of 6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide?
The InChIKey is AILNJIBFXARDHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O2/c20-13-7-6-11(17-18-13)14(21)16-10-4-1-2-5-12(10)19-9-3-8-15-19/h1-5,8-9H,6-7H2,(H,16,21)(H,18,20).
What are the key properties of 6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide?
6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide has a molecular weight of 283.29 g/mol, XLogP of 1.08, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-(2-pyrazol-1-ylphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 61276124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).