[1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine

C16H24N4S — CID 105311732

IUPAC[1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine
SMILESNNC(Cc1ccsc1)Cc1ccn(C2CCCCC2)n1
InChIInChI=1S/C16H24N4S/c17-18-15(10-13-7-9-21-12-13)11-14-6-8-20(19-14)16-4-2-1-3-5-16/h6-9,12,15-16,18H,1-5,10-11,17H2
InChIKeyCOLRIRYCUVAIDZ-UHFFFAOYSA-N
MW304.46 g/mol
LogP3.07
Rot. Bonds6

About [1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine

[1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine (PubChem CID 105311732) has the molecular formula C16H24N4S and a molecular weight of 304.46 g/mol. Its IUPAC name is [1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine
PubChem CID105311732
Molecular FormulaC16H24N4S
Molecular Weight304.46 g/mol
Exact Mass304.17
IUPAC Name[1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine
SMILESNNC(Cc1ccsc1)Cc1ccn(C2CCCCC2)n1
InChIInChI=1S/C16H24N4S/c17-18-15(10-13-7-9-21-12-13)11-14-6-8-20(19-14)16-4-2-1-3-5-16/h6-9,12,15-16,18H,1-5,10-11,17H2
InChIKeyCOLRIRYCUVAIDZ-UHFFFAOYSA-N
XLogP3.07
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.46
LogP ≤ 53.07
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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Frequently Asked Questions

What is the IUPAC name of [1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine?
The IUPAC name of [1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine (CID 105311732) is [1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine.
What is the SMILES notation for [1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine?
The canonical SMILES for [1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine is NNC(Cc1ccsc1)Cc1ccn(C2CCCCC2)n1.
What is the InChIKey of [1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine?
The InChIKey is COLRIRYCUVAIDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4S/c17-18-15(10-13-7-9-21-12-13)11-14-6-8-20(19-14)16-4-2-1-3-5-16/h6-9,12,15-16,18H,1-5,10-11,17H2.
What are the key properties of [1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine?
[1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine has a molecular weight of 304.46 g/mol, XLogP of 3.07, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-cyclohexylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-yl]hydrazine is sourced from PubChem (CID 105311732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).