[5-(chloromethyl)thiophen-3-yl]hydrazine

C5H7ClN2S — CID 57239316

IUPAC[5-(chloromethyl)thiophen-3-yl]hydrazine
SMILESNNc1csc(CCl)c1
InChIInChI=1S/C5H7ClN2S/c6-2-5-1-4(8-7)3-9-5/h1,3,8H,2,7H2
InChIKeyJALCGYATYFOYJP-UHFFFAOYSA-N
MW162.65 g/mol
LogP1.77
Rot. Bonds2

About [5-(chloromethyl)thiophen-3-yl]hydrazine

[5-(chloromethyl)thiophen-3-yl]hydrazine (PubChem CID 57239316) has the molecular formula C5H7ClN2S and a molecular weight of 162.65 g/mol. Its IUPAC name is [5-(chloromethyl)thiophen-3-yl]hydrazine.

Molecular Properties

Compound Name[5-(chloromethyl)thiophen-3-yl]hydrazine
PubChem CID57239316
Molecular FormulaC5H7ClN2S
Molecular Weight162.65 g/mol
Exact Mass162.00
IUPAC Name[5-(chloromethyl)thiophen-3-yl]hydrazine
SMILESNNc1csc(CCl)c1
InChIInChI=1S/C5H7ClN2S/c6-2-5-1-4(8-7)3-9-5/h1,3,8H,2,7H2
InChIKeyJALCGYATYFOYJP-UHFFFAOYSA-N
XLogP1.77
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.65
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'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 [5-(chloromethyl)thiophen-3-yl]hydrazine?
The IUPAC name of [5-(chloromethyl)thiophen-3-yl]hydrazine (CID 57239316) is [5-(chloromethyl)thiophen-3-yl]hydrazine.
What is the SMILES notation for [5-(chloromethyl)thiophen-3-yl]hydrazine?
The canonical SMILES for [5-(chloromethyl)thiophen-3-yl]hydrazine is NNc1csc(CCl)c1.
What is the InChIKey of [5-(chloromethyl)thiophen-3-yl]hydrazine?
The InChIKey is JALCGYATYFOYJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7ClN2S/c6-2-5-1-4(8-7)3-9-5/h1,3,8H,2,7H2.
What are the key properties of [5-(chloromethyl)thiophen-3-yl]hydrazine?
[5-(chloromethyl)thiophen-3-yl]hydrazine has a molecular weight of 162.65 g/mol, XLogP of 1.77, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(chloromethyl)thiophen-3-yl]hydrazine is sourced from PubChem (CID 57239316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).