4-fluoro-1H-pyrazole-5-carboxamide

C4H4FN3O — CID 15374528

IUPAC4-fluoro-1H-pyrazole-5-carboxamide
SMILESNC(=O)c1[nH]ncc1F
InChIInChI=1S/C4H4FN3O/c5-2-1-7-8-3(2)4(6)9/h1H,(H2,6,9)(H,7,8)
InChIKeyPPVABJLIUGNVGE-UHFFFAOYSA-N
MW129.09 g/mol
LogP-0.35
Rot. Bonds1

About 4-fluoro-1H-pyrazole-5-carboxamide

4-fluoro-1H-pyrazole-5-carboxamide (PubChem CID 15374528) has the molecular formula C4H4FN3O and a molecular weight of 129.09 g/mol. Its IUPAC name is 4-fluoro-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-fluoro-1H-pyrazole-5-carboxamide
PubChem CID15374528
Molecular FormulaC4H4FN3O
Molecular Weight129.09 g/mol
Exact Mass129.03
IUPAC Name4-fluoro-1H-pyrazole-5-carboxamide
SMILESNC(=O)c1[nH]ncc1F
InChIInChI=1S/C4H4FN3O/c5-2-1-7-8-3(2)4(6)9/h1H,(H2,6,9)(H,7,8)
InChIKeyPPVABJLIUGNVGE-UHFFFAOYSA-N
XLogP-0.35
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.09
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-fluoro-1H-pyrazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-amino-1H-pyrazole-5-carboxamide
CID 580973
1H-pyrazole-5-carbohydrazide
CID 7147494
1H-Pyrazole-5-carboxamide
CID 15239624
2H,6H,7H-pyrazolo(3,4-d)pyridazin-7-one
CID 15451646
4-((1E)-3,3-Dimethyltriaz-1-en-1-yl)-1H-pyrazole-3-carboxamide
CID 279946
4-methyl-1H-pyrazole-3-carbohydrazide
CID 13405304
4-methyl-1H-pyrazole-3-carboxamide
CID 19376020
4-Chloro-1H-pyrazole-3-carboxamide
CID 46318315
4-fluoro-1H-pyrazole-5-carbaldehyde
CID 148830402
Pyrazole-3,4-dicarboxamide
CID 23164597
Amino-1h-pyrazolecarboxamide
CID 15152502
4-bromo-1H-pyrazole-5-carbohydrazide
CID 7147493

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1H-pyrazole-5-carboxamide?
The IUPAC name of 4-fluoro-1H-pyrazole-5-carboxamide (CID 15374528) is 4-fluoro-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 4-fluoro-1H-pyrazole-5-carboxamide?
The canonical SMILES for 4-fluoro-1H-pyrazole-5-carboxamide is NC(=O)c1[nH]ncc1F.
What is the InChIKey of 4-fluoro-1H-pyrazole-5-carboxamide?
The InChIKey is PPVABJLIUGNVGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4FN3O/c5-2-1-7-8-3(2)4(6)9/h1H,(H2,6,9)(H,7,8).
What are the key properties of 4-fluoro-1H-pyrazole-5-carboxamide?
4-fluoro-1H-pyrazole-5-carboxamide has a molecular weight of 129.09 g/mol, XLogP of -0.35, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 15374528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).