1H-pyrazole-4,5-dicarboxamide

C5H6N4O2 — CID 23164597

IUPAC1H-pyrazole-4,5-dicarboxamide
SMILESNC(=O)c1cn[nH]c1C(N)=O
InChIInChI=1S/C5H6N4O2/c6-4(10)2-1-8-9-3(2)5(7)11/h1H,(H2,6,10)(H2,7,11)(H,8,9)
InChIKeyPZJLXGCJHYJOIP-UHFFFAOYSA-N
MW154.13 g/mol
LogP-1.39
Rot. Bonds2

About 1H-pyrazole-4,5-dicarboxamide

1H-pyrazole-4,5-dicarboxamide (PubChem CID 23164597) has the molecular formula C5H6N4O2 and a molecular weight of 154.13 g/mol. Its IUPAC name is 1H-pyrazole-4,5-dicarboxamide.

Molecular Properties

Compound Name1H-pyrazole-4,5-dicarboxamide
PubChem CID23164597
Molecular FormulaC5H6N4O2
Molecular Weight154.13 g/mol
Exact Mass154.05
IUPAC Name1H-pyrazole-4,5-dicarboxamide
SMILESNC(=O)c1cn[nH]c1C(N)=O
InChIInChI=1S/C5H6N4O2/c6-4(10)2-1-8-9-3(2)5(7)11/h1H,(H2,6,10)(H2,7,11)(H,8,9)
InChIKeyPZJLXGCJHYJOIP-UHFFFAOYSA-N
XLogP-1.39
TPSA114.86 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.13
LogP ≤ 5-1.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1H-pyrazole-4,5-dicarboxamide 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
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
1H,4H,5H-pyrazolo(3,4-d)pyridazin-4-one
CID 12240775
4-methyl-1H-pyrazole-3-carbohydrazide
CID 13405304
4-methyl-1H-pyrazole-3-carboxamide
CID 19376020
3-methyl-1H-pyrazole-4-carbohydrazide
CID 50987772
4-Fluoro-1h-pyrazole-3-carboxamide
CID 15374528
Pyrrolo(3,4-c)pyrazole-4,6-dione
CID 19102688
5-(Trifluoromethyl)-1H-pyrazole-4-carboxamide
CID 66781137
5-(aminomethyl)-1H-pyrazole-4-carbohydrazide dihydrochloride
CID 165915953
4-Methylpyrazole-3-carboxamide hydrochloride
CID 19376019

Frequently Asked Questions

What is the IUPAC name of 1H-pyrazole-4,5-dicarboxamide?
The IUPAC name of 1H-pyrazole-4,5-dicarboxamide (CID 23164597) is 1H-pyrazole-4,5-dicarboxamide.
What is the SMILES notation for 1H-pyrazole-4,5-dicarboxamide?
The canonical SMILES for 1H-pyrazole-4,5-dicarboxamide is NC(=O)c1cn[nH]c1C(N)=O.
What is the InChIKey of 1H-pyrazole-4,5-dicarboxamide?
The InChIKey is PZJLXGCJHYJOIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N4O2/c6-4(10)2-1-8-9-3(2)5(7)11/h1H,(H2,6,10)(H2,7,11)(H,8,9).
What are the key properties of 1H-pyrazole-4,5-dicarboxamide?
1H-pyrazole-4,5-dicarboxamide has a molecular weight of 154.13 g/mol, XLogP of -1.39, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-pyrazole-4,5-dicarboxamide is sourced from PubChem (CID 23164597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).