4-ethyl-1H-pyrazole-5-carboxamide

C6H9N3O — CID 91280769

IUPAC4-ethyl-1H-pyrazole-5-carboxamide
SMILESCCc1cn[nH]c1C(N)=O
InChIInChI=1S/C6H9N3O/c1-2-4-3-8-9-5(4)6(7)10/h3H,2H2,1H3,(H2,7,10)(H,8,9)
InChIKeyLSBOXVUUXPSXEX-UHFFFAOYSA-N
MW139.16 g/mol
LogP0.07
Rot. Bonds2

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

4-ethyl-1H-pyrazole-5-carboxamide (PubChem CID 91280769) has the molecular formula C6H9N3O and a molecular weight of 139.16 g/mol. Its IUPAC name is 4-ethyl-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-ethyl-1H-pyrazole-5-carboxamide
PubChem CID91280769
Molecular FormulaC6H9N3O
Molecular Weight139.16 g/mol
Exact Mass139.07
IUPAC Name4-ethyl-1H-pyrazole-5-carboxamide
SMILESCCc1cn[nH]c1C(N)=O
InChIInChI=1S/C6H9N3O/c1-2-4-3-8-9-5(4)6(7)10/h3H,2H2,1H3,(H2,7,10)(H,8,9)
InChIKeyLSBOXVUUXPSXEX-UHFFFAOYSA-N
XLogP0.07
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.16
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-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

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1H-pyrazole-5-carboxamide?
The IUPAC name of 4-ethyl-1H-pyrazole-5-carboxamide (CID 91280769) is 4-ethyl-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 4-ethyl-1H-pyrazole-5-carboxamide?
The canonical SMILES for 4-ethyl-1H-pyrazole-5-carboxamide is CCc1cn[nH]c1C(N)=O.
What is the InChIKey of 4-ethyl-1H-pyrazole-5-carboxamide?
The InChIKey is LSBOXVUUXPSXEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O/c1-2-4-3-8-9-5(4)6(7)10/h3H,2H2,1H3,(H2,7,10)(H,8,9).
What are the key properties of 4-ethyl-1H-pyrazole-5-carboxamide?
4-ethyl-1H-pyrazole-5-carboxamide has a molecular weight of 139.16 g/mol, XLogP of 0.07, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 91280769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).