[(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine

C12H18N4S — CID 102813127

IUPAC[(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine
SMILESCCc1nn(C)cc1C(NN)c1csc(C)c1
InChIInChI=1S/C12H18N4S/c1-4-11-10(6-16(3)15-11)12(14-13)9-5-8(2)17-7-9/h5-7,12,14H,4,13H2,1-3H3
InChIKeyLFWNWVSQHWIMNR-UHFFFAOYSA-N
MW250.37 g/mol
LogP1.91
Rot. Bonds4

About [(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine

[(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine (PubChem CID 102813127) has the molecular formula C12H18N4S and a molecular weight of 250.37 g/mol. Its IUPAC name is [(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine
PubChem CID102813127
Molecular FormulaC12H18N4S
Molecular Weight250.37 g/mol
Exact Mass250.13
IUPAC Name[(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine
SMILESCCc1nn(C)cc1C(NN)c1csc(C)c1
InChIInChI=1S/C12H18N4S/c1-4-11-10(6-16(3)15-11)12(14-13)9-5-8(2)17-7-9/h5-7,12,14H,4,13H2,1-3H3
InChIKeyLFWNWVSQHWIMNR-UHFFFAOYSA-N
XLogP1.91
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.37
LogP ≤ 51.91
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

[(3-chloro-4-methylphenyl)-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine
CID 107562686
[(3-ethyl-1-methylpyrazol-4-yl)-(3-fluoro-4-methylphenyl)methyl]hydrazine
CID 107131050
[(3-ethyl-1-methylpyrazol-4-yl)-thiophen-2-ylmethyl]hydrazine
CID 102813003
[(1,5-dimethylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313281
[(3-ethyl-1-methylpyrazol-4-yl)-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine
CID 106884592
[1-(3-ethyl-1-methylpyrazol-4-yl)-2,2-dimethylpropyl]hydrazine
CID 102813091
[3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine
CID 102813272
[(5-methylthiophen-3-yl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine
CID 105230618
[(2-methylsulfanylphenyl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313270
[(2,5-dimethylfuran-3-yl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313245
[(3-ethylthiophen-2-yl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313192
[(3-ethyl-1-methylpyrazol-4-yl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 102813247

Frequently Asked Questions

What is the IUPAC name of [(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine?
The IUPAC name of [(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine (CID 102813127) is [(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine.
What is the SMILES notation for [(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine?
The canonical SMILES for [(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine is CCc1nn(C)cc1C(NN)c1csc(C)c1.
What is the InChIKey of [(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine?
The InChIKey is LFWNWVSQHWIMNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4S/c1-4-11-10(6-16(3)15-11)12(14-13)9-5-8(2)17-7-9/h5-7,12,14H,4,13H2,1-3H3.
What are the key properties of [(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine?
[(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine has a molecular weight of 250.37 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-ethyl-1-methylpyrazol-4-yl)-(5-methylthiophen-3-yl)methyl]hydrazine is sourced from PubChem (CID 102813127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).