4-amino-1-ethylpyrazole-3-carbohydrazide

C6H11N5O — CID 7017118

IUPAC4-amino-1-ethylpyrazole-3-carbohydrazide
SMILESCCn1cc(N)c(C(=O)NN)n1
InChIInChI=1S/C6H11N5O/c1-2-11-3-4(7)5(10-11)6(12)9-8/h3H,2,7-8H2,1H3,(H,9,12)
InChIKeyULPBRFNMDWXSHK-UHFFFAOYSA-N
MW169.19 g/mol
LogP-0.91
Rot. Bonds2

About 4-amino-1-ethylpyrazole-3-carbohydrazide

4-amino-1-ethylpyrazole-3-carbohydrazide (PubChem CID 7017118) has the molecular formula C6H11N5O and a molecular weight of 169.19 g/mol. Its IUPAC name is 4-amino-1-ethylpyrazole-3-carbohydrazide.

Molecular Properties

Compound Name4-amino-1-ethylpyrazole-3-carbohydrazide
PubChem CID7017118
Molecular FormulaC6H11N5O
Molecular Weight169.19 g/mol
Exact Mass169.10
IUPAC Name4-amino-1-ethylpyrazole-3-carbohydrazide
SMILESCCn1cc(N)c(C(=O)NN)n1
InChIInChI=1S/C6H11N5O/c1-2-11-3-4(7)5(10-11)6(12)9-8/h3H,2,7-8H2,1H3,(H,9,12)
InChIKeyULPBRFNMDWXSHK-UHFFFAOYSA-N
XLogP-0.91
TPSA98.96 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.19
LogP ≤ 5-0.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-amino-1-ethylpyrazole-3-carbohydrazide 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-amino-1-ethylpyrazole-3-carbohydrazide?
The IUPAC name of 4-amino-1-ethylpyrazole-3-carbohydrazide (CID 7017118) is 4-amino-1-ethylpyrazole-3-carbohydrazide.
What is the SMILES notation for 4-amino-1-ethylpyrazole-3-carbohydrazide?
The canonical SMILES for 4-amino-1-ethylpyrazole-3-carbohydrazide is CCn1cc(N)c(C(=O)NN)n1.
What is the InChIKey of 4-amino-1-ethylpyrazole-3-carbohydrazide?
The InChIKey is ULPBRFNMDWXSHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N5O/c1-2-11-3-4(7)5(10-11)6(12)9-8/h3H,2,7-8H2,1H3,(H,9,12).
What are the key properties of 4-amino-1-ethylpyrazole-3-carbohydrazide?
4-amino-1-ethylpyrazole-3-carbohydrazide has a molecular weight of 169.19 g/mol, XLogP of -0.91, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethylpyrazole-3-carbohydrazide is sourced from PubChem (CID 7017118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).