5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide

C9H8N4O2 — CID 110467687

IUPAC5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide
SMILESO=C1CC(C(=O)Nc2ccncc2)=NN1
InChIInChI=1S/C9H8N4O2/c14-8-5-7(12-13-8)9(15)11-6-1-3-10-4-2-6/h1-4H,5H2,(H,13,14)(H,10,11,15)
InChIKeyFLWGBVKUHWOWTD-UHFFFAOYSA-N
MW204.19 g/mol
LogP-0.10
Rot. Bonds2

About 5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide

5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide (PubChem CID 110467687) has the molecular formula C9H8N4O2 and a molecular weight of 204.19 g/mol. Its IUPAC name is 5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide.

Molecular Properties

Compound Name5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide
PubChem CID110467687
Molecular FormulaC9H8N4O2
Molecular Weight204.19 g/mol
Exact Mass204.06
IUPAC Name5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide
SMILESO=C1CC(C(=O)Nc2ccncc2)=NN1
InChIInChI=1S/C9H8N4O2/c14-8-5-7(12-13-8)9(15)11-6-1-3-10-4-2-6/h1-4H,5H2,(H,13,14)(H,10,11,15)
InChIKeyFLWGBVKUHWOWTD-UHFFFAOYSA-N
XLogP-0.10
TPSA83.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide
CID 110467708
2-[4-[(5-oxo-1,4-dihydropyrazole-3-carbonyl)amino]phenyl]acetic acid
CID 110467839
N-(2-cyclopropylpyrimidin-5-yl)-5-oxo-1,4-dihydropyrazole-3-carboxamide
CID 167766294
N-(3-methylphenyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 43397609
N-tert-butyl-5-oxo-1,4-dihydropyrazole-3-carboxamide
CID 110467674
N-benzyl-5-oxo-1,4-dihydropyrazole-3-carboxamide
CID 110467706
N-(3-bromo-4-methylphenyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 60730194
N-[4-(1H-imidazol-5-yl)phenyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 60666303
N-(3-chloro-4-fluorophenyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 4539970
methanol;N-pyridin-4-ylpyridine-4-carboxamide
CID 158472241
2,5-dibromo-1-N,4-N-dipyridin-4-ylbenzene-1,4-dicarboxamide
CID 35828938
N-(4-ethoxyphenyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 22107791

Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide?
The IUPAC name of 5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide (CID 110467687) is 5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide.
What is the SMILES notation for 5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide?
The canonical SMILES for 5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide is O=C1CC(C(=O)Nc2ccncc2)=NN1.
What is the InChIKey of 5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide?
The InChIKey is FLWGBVKUHWOWTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N4O2/c14-8-5-7(12-13-8)9(15)11-6-1-3-10-4-2-6/h1-4H,5H2,(H,13,14)(H,10,11,15).
What are the key properties of 5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide?
5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide has a molecular weight of 204.19 g/mol, XLogP of -0.10, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide is sourced from PubChem (CID 110467687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).