[1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine

C12H24N4O2 — CID 105246299

IUPAC[1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine
SMILESCCOC(OCC)C(Cc1cnn(CC)c1)NN
InChIInChI=1S/C12H24N4O2/c1-4-16-9-10(8-14-16)7-11(15-13)12(17-5-2)18-6-3/h8-9,11-12,15H,4-7,13H2,1-3H3
InChIKeyXSTNKQVNAXSCAE-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.68
Rot. Bonds9

About [1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine

[1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine (PubChem CID 105246299) has the molecular formula C12H24N4O2 and a molecular weight of 256.35 g/mol. Its IUPAC name is [1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine
PubChem CID105246299
Molecular FormulaC12H24N4O2
Molecular Weight256.35 g/mol
Exact Mass256.19
IUPAC Name[1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine
SMILESCCOC(OCC)C(Cc1cnn(CC)c1)NN
InChIInChI=1S/C12H24N4O2/c1-4-16-9-10(8-14-16)7-11(15-13)12(17-5-2)18-6-3/h8-9,11-12,15H,4-7,13H2,1-3H3
InChIKeyXSTNKQVNAXSCAE-UHFFFAOYSA-N
XLogP0.68
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze [1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine 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

[1-(1-ethylpyrazol-4-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine
CID 103025218
[3-(1-ethylpyrazol-4-yl)-1-methoxy-1-phenylpropan-2-yl]hydrazine
CID 105279023
[1-(1-ethylpyrazol-4-yl)-4-methylhexan-2-yl]hydrazine
CID 105291388
3-ethoxy-1-(1-ethylpyrazol-4-yl)pentan-2-ol
CID 116711224
[1-cyclobutyl-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine
CID 103170429
[3-ethoxy-1-(1-methylpyrazol-4-yl)hexan-2-yl]hydrazine
CID 105271422
[4-cyclopentyl-1-(1-ethylpyrazol-4-yl)butan-2-yl]hydrazine
CID 105291380
1,1-diethoxy-3-(1-methylpyrazol-4-yl)-N-propylpropan-2-amine
CID 79495508
2-[(1-ethylpyrazol-4-yl)methyl]butan-1-amine
CID 62505904
2-ethoxy-N-[(1-ethylpyrazol-4-yl)methyl]propan-1-amine
CID 115655686
2-amino-3-(1-ethylpyrazol-4-yl)propan-1-ol
CID 64571799
1-(1-ethylpyrazol-4-yl)-3-methyl-N-propylbutan-2-amine
CID 62125581

Frequently Asked Questions

What is the IUPAC name of [1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine?
The IUPAC name of [1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine (CID 105246299) is [1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine.
What is the SMILES notation for [1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine?
The canonical SMILES for [1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine is CCOC(OCC)C(Cc1cnn(CC)c1)NN.
What is the InChIKey of [1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine?
The InChIKey is XSTNKQVNAXSCAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O2/c1-4-16-9-10(8-14-16)7-11(15-13)12(17-5-2)18-6-3/h8-9,11-12,15H,4-7,13H2,1-3H3.
What are the key properties of [1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine?
[1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine has a molecular weight of 256.35 g/mol, XLogP of 0.68, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1,1-diethoxy-3-(1-ethylpyrazol-4-yl)propan-2-yl]hydrazine is sourced from PubChem (CID 105246299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).