4-(1-propylpyrazol-4-yl)oxypentanehydrazide

C11H20N4O2 — CID 116804100

IUPAC4-(1-propylpyrazol-4-yl)oxypentanehydrazide
SMILESCCCn1cc(OC(C)CCC(=O)NN)cn1
InChIInChI=1S/C11H20N4O2/c1-3-6-15-8-10(7-13-15)17-9(2)4-5-11(16)14-12/h7-9H,3-6,12H2,1-2H3,(H,14,16)
InChIKeyBMRWAAFHLNMTGL-UHFFFAOYSA-N
MW240.31 g/mol
LogP0.83
Rot. Bonds7

About 4-(1-propylpyrazol-4-yl)oxypentanehydrazide

4-(1-propylpyrazol-4-yl)oxypentanehydrazide (PubChem CID 116804100) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is 4-(1-propylpyrazol-4-yl)oxypentanehydrazide.

Molecular Properties

Compound Name4-(1-propylpyrazol-4-yl)oxypentanehydrazide
PubChem CID116804100
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name4-(1-propylpyrazol-4-yl)oxypentanehydrazide
SMILESCCCn1cc(OC(C)CCC(=O)NN)cn1
InChIInChI=1S/C11H20N4O2/c1-3-6-15-8-10(7-13-15)17-9(2)4-5-11(16)14-12/h7-9H,3-6,12H2,1-2H3,(H,14,16)
InChIKeyBMRWAAFHLNMTGL-UHFFFAOYSA-N
XLogP0.83
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 50.83
H-Bond Donors ≤ 52
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'}

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Related Compounds

3-methyl-2-(1-propylpyrazol-4-yl)oxybutanoic acid
CID 116799986
2-(1-propylpyrazol-4-yl)oxybutanamide
CID 116804832
N-butan-2-yl-2-(1-propylpyrazol-4-yl)oxypropanamide
CID 116804928
N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide
CID 116804964
4-propoxy-1-propylpyrazole
CID 116805185
4-(4-methylsulfanylphenoxy)pentanehydrazide
CID 55246737
butyl 4-hydroxy-4-(1-propylpyrazol-4-yl)butanoate
CID 103572850
4-(4-methylpyrazol-1-yl)butanehydrazide
CID 63578152
methyl 2-amino-2-(1-propylpyrazol-4-yl)acetate
CID 103572127
N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide
CID 115319745
4-(4-cyanophenoxy)pentanehydrazide
CID 63574803
ethyl 2-(methylamino)-4-(4-propoxypyrazol-1-yl)butanoate
CID 114274344

Frequently Asked Questions

What is the IUPAC name of 4-(1-propylpyrazol-4-yl)oxypentanehydrazide?
The IUPAC name of 4-(1-propylpyrazol-4-yl)oxypentanehydrazide (CID 116804100) is 4-(1-propylpyrazol-4-yl)oxypentanehydrazide.
What is the SMILES notation for 4-(1-propylpyrazol-4-yl)oxypentanehydrazide?
The canonical SMILES for 4-(1-propylpyrazol-4-yl)oxypentanehydrazide is CCCn1cc(OC(C)CCC(=O)NN)cn1.
What is the InChIKey of 4-(1-propylpyrazol-4-yl)oxypentanehydrazide?
The InChIKey is BMRWAAFHLNMTGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-3-6-15-8-10(7-13-15)17-9(2)4-5-11(16)14-12/h7-9H,3-6,12H2,1-2H3,(H,14,16).
What are the key properties of 4-(1-propylpyrazol-4-yl)oxypentanehydrazide?
4-(1-propylpyrazol-4-yl)oxypentanehydrazide has a molecular weight of 240.31 g/mol, XLogP of 0.83, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-propylpyrazol-4-yl)oxypentanehydrazide is sourced from PubChem (CID 116804100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).