[2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine

C15H22N4S — CID 105318994

IUPAC[2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine
SMILESCCn1nc(C)cc1CC(NN)c1ccccc1SC
InChIInChI=1S/C15H22N4S/c1-4-19-12(9-11(2)18-19)10-14(17-16)13-7-5-6-8-15(13)20-3/h5-9,14,17H,4,10,16H2,1-3H3
InChIKeyFGGGDHCKEHDPEW-UHFFFAOYSA-N
MW290.44 g/mol
LogP2.68
Rot. Bonds6

About [2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine

[2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine (PubChem CID 105318994) has the molecular formula C15H22N4S and a molecular weight of 290.44 g/mol. Its IUPAC name is [2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine
PubChem CID105318994
Molecular FormulaC15H22N4S
Molecular Weight290.44 g/mol
Exact Mass290.16
IUPAC Name[2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine
SMILESCCn1nc(C)cc1CC(NN)c1ccccc1SC
InChIInChI=1S/C15H22N4S/c1-4-19-12(9-11(2)18-19)10-14(17-16)13-7-5-6-8-15(13)20-3/h5-9,14,17H,4,10,16H2,1-3H3
InChIKeyFGGGDHCKEHDPEW-UHFFFAOYSA-N
XLogP2.68
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.44
LogP ≤ 52.68
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 [2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine?
The IUPAC name of [2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine (CID 105318994) is [2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine is CCn1nc(C)cc1CC(NN)c1ccccc1SC.
What is the InChIKey of [2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine?
The InChIKey is FGGGDHCKEHDPEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4S/c1-4-19-12(9-11(2)18-19)10-14(17-16)13-7-5-6-8-15(13)20-3/h5-9,14,17H,4,10,16H2,1-3H3.
What are the key properties of [2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine?
[2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine has a molecular weight of 290.44 g/mol, XLogP of 2.68, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-ethyl-5-methylpyrazol-3-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105318994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).