[2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine

C15H21ClN4S — CID 105316821

IUPAC[2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
SMILESCCc1nn(C)c(CC(NN)c2cc3c(s2)CCC3)c1Cl
InChIInChI=1S/C15H21ClN4S/c1-3-10-15(16)12(20(2)19-10)8-11(18-17)14-7-9-5-4-6-13(9)21-14/h7,11,18H,3-6,8,17H2,1-2H3
InChIKeyBZXPUZCGLCTSLJ-UHFFFAOYSA-N
MW324.88 g/mol
LogP2.93
Rot. Bonds5

About [2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine

[2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine (PubChem CID 105316821) has the molecular formula C15H21ClN4S and a molecular weight of 324.88 g/mol. Its IUPAC name is [2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
PubChem CID105316821
Molecular FormulaC15H21ClN4S
Molecular Weight324.88 g/mol
Exact Mass324.12
IUPAC Name[2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
SMILESCCc1nn(C)c(CC(NN)c2cc3c(s2)CCC3)c1Cl
InChIInChI=1S/C15H21ClN4S/c1-3-10-15(16)12(20(2)19-10)8-11(18-17)14-7-9-5-4-6-13(9)21-14/h7,11,18H,3-6,8,17H2,1-2H3
InChIKeyBZXPUZCGLCTSLJ-UHFFFAOYSA-N
XLogP2.93
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.88
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethanol
CID 115813023
2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanamine
CID 104998335
[2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5-chlorothiophen-2-yl)ethyl]hydrazine
CID 105316820
[2-(2,6-dichlorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
CID 105293121
2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(4,5-dibromothiophen-2-yl)-N-methylethanamine
CID 104998520
[2-(4-chlorophenyl)-1-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethyl]hydrazine
CID 105283232
[2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine
CID 105279877
[2-(5-chloro-2-fluorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
CID 103053843
[2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5-ethylfuran-2-yl)ethyl]hydrazine
CID 105316860
[2-(2,3-dichlorophenyl)-1-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethyl]hydrazine
CID 107312914
[2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(2,6-difluorophenyl)ethyl]hydrazine
CID 105246689
[2-(4-chloro-2-fluorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
CID 105342696

Frequently Asked Questions

What is the IUPAC name of [2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine (CID 105316821) is [2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine is CCc1nn(C)c(CC(NN)c2cc3c(s2)CCC3)c1Cl.
What is the InChIKey of [2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine?
The InChIKey is BZXPUZCGLCTSLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN4S/c1-3-10-15(16)12(20(2)19-10)8-11(18-17)14-7-9-5-4-6-13(9)21-14/h7,11,18H,3-6,8,17H2,1-2H3.
What are the key properties of [2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine?
[2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine has a molecular weight of 324.88 g/mol, XLogP of 2.93, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105316821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).