[(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine

C12H18N4S — CID 105318757

IUPAC[(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine
SMILESCCn1nc(C)cc1C(NN)c1ccc(C)s1
InChIInChI=1S/C12H18N4S/c1-4-16-10(7-8(2)15-16)12(14-13)11-6-5-9(3)17-11/h5-7,12,14H,4,13H2,1-3H3
InChIKeyBOWGRCMQQBTRAD-UHFFFAOYSA-N
MW250.37 g/mol
LogP2.13
Rot. Bonds4

About [(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine

[(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine (PubChem CID 105318757) has the molecular formula C12H18N4S and a molecular weight of 250.37 g/mol. Its IUPAC name is [(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine
PubChem CID105318757
Molecular FormulaC12H18N4S
Molecular Weight250.37 g/mol
Exact Mass250.13
IUPAC Name[(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine
SMILESCCn1nc(C)cc1C(NN)c1ccc(C)s1
InChIInChI=1S/C12H18N4S/c1-4-16-10(7-8(2)15-16)12(14-13)11-6-5-9(3)17-11/h5-7,12,14H,4,13H2,1-3H3
InChIKeyBOWGRCMQQBTRAD-UHFFFAOYSA-N
XLogP2.13
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 ≤ 52.13
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-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine?
The IUPAC name of [(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine (CID 105318757) is [(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine.
What is the SMILES notation for [(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine?
The canonical SMILES for [(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine is CCn1nc(C)cc1C(NN)c1ccc(C)s1.
What is the InChIKey of [(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine?
The InChIKey is BOWGRCMQQBTRAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4S/c1-4-16-10(7-8(2)15-16)12(14-13)11-6-5-9(3)17-11/h5-7,12,14H,4,13H2,1-3H3.
What are the key properties of [(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine?
[(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine has a molecular weight of 250.37 g/mol, XLogP of 2.13, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-ethyl-5-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine is sourced from PubChem (CID 105318757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).