[3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine

C15H28N4O2 — CID 105246329

IUPAC[3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine
SMILESCCOC(OCC)C(Cc1ccn(C2CCCC2)n1)NN
InChIInChI=1S/C15H28N4O2/c1-3-20-15(21-4-2)14(17-16)11-12-9-10-19(18-12)13-7-5-6-8-13/h9-10,13-15,17H,3-8,11,16H2,1-2H3
InChIKeyITHPCSSFSREGGH-UHFFFAOYSA-N
MW296.42 g/mol
LogP1.77
Rot. Bonds9

About [3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine

[3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine (PubChem CID 105246329) has the molecular formula C15H28N4O2 and a molecular weight of 296.42 g/mol. Its IUPAC name is [3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine.

Molecular Properties

Compound Name[3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine
PubChem CID105246329
Molecular FormulaC15H28N4O2
Molecular Weight296.42 g/mol
Exact Mass296.22
IUPAC Name[3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine
SMILESCCOC(OCC)C(Cc1ccn(C2CCCC2)n1)NN
InChIInChI=1S/C15H28N4O2/c1-3-20-15(21-4-2)14(17-16)11-12-9-10-19(18-12)13-7-5-6-8-13/h9-10,13-15,17H,3-8,11,16H2,1-2H3
InChIKeyITHPCSSFSREGGH-UHFFFAOYSA-N
XLogP1.77
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 51.77
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'}

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Related Compounds

3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-ol
CID 79495174
1-(1-cyclopentylpyrazol-3-yl)-3-ethoxy-N-methylbutan-2-amine
CID 64778824
[3-(1-cyclopentylpyrazol-3-yl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine
CID 105272726
[1-(1-cyclopentylpyrazol-3-yl)-3-ethoxy-3-methylbutan-2-yl]hydrazine
CID 105274040
[1-cyclopentyl-3-(1-cyclopentylpyrazol-3-yl)propan-2-yl]hydrazine
CID 105314445
[1-(1-cyclohexylpyrazol-3-yl)-4-methylpentan-2-yl]hydrazine
CID 105199131
[1-(1-cyclopentylpyrazol-3-yl)-3-ethyl-3-methoxypentan-2-yl]hydrazine
CID 105275362
4-(1-cyclopentylpyrazol-3-yl)-N,N-diethyl-3-hydrazinylbutan-1-amine
CID 105244030
1-(1-cyclopentylpyrazol-3-yl)butan-2-amine
CID 64785877
1-(1-cyclopentylpyrazol-3-yl)-4-ethoxy-N-methylbutan-2-amine
CID 105157055
[1-(1-cyclohexylpyrazol-3-yl)-5-methoxyhexan-2-yl]hydrazine
CID 105311723
[1-(1-cyclopentylpyrazol-3-yl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine
CID 103217560

Frequently Asked Questions

What is the IUPAC name of [3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine?
The IUPAC name of [3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine (CID 105246329) is [3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine.
What is the SMILES notation for [3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine?
The canonical SMILES for [3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine is CCOC(OCC)C(Cc1ccn(C2CCCC2)n1)NN.
What is the InChIKey of [3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine?
The InChIKey is ITHPCSSFSREGGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O2/c1-3-20-15(21-4-2)14(17-16)11-12-9-10-19(18-12)13-7-5-6-8-13/h9-10,13-15,17H,3-8,11,16H2,1-2H3.
What are the key properties of [3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine?
[3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine has a molecular weight of 296.42 g/mol, XLogP of 1.77, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-yl]hydrazine is sourced from PubChem (CID 105246329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).