[cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine

C8H14N4S — CID 105340044

IUPAC[cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine
SMILESCc1nnsc1C(NN)C1CCC1
InChIInChI=1S/C8H14N4S/c1-5-8(13-12-11-5)7(10-9)6-3-2-4-6/h6-7,10H,2-4,9H2,1H3
InChIKeyDJZLQKQOUAWJRK-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.15
Rot. Bonds3

About [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine

[cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine (PubChem CID 105340044) has the molecular formula C8H14N4S and a molecular weight of 198.29 g/mol. Its IUPAC name is [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine
PubChem CID105340044
Molecular FormulaC8H14N4S
Molecular Weight198.29 g/mol
Exact Mass198.09
IUPAC Name[cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine
SMILESCc1nnsc1C(NN)C1CCC1
InChIInChI=1S/C8H14N4S/c1-5-8(13-12-11-5)7(10-9)6-3-2-4-6/h6-7,10H,2-4,9H2,1H3
InChIKeyDJZLQKQOUAWJRK-UHFFFAOYSA-N
XLogP1.15
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.15
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 [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The IUPAC name of [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine (CID 105340044) is [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The canonical SMILES for [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine is Cc1nnsc1C(NN)C1CCC1.
What is the InChIKey of [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The InChIKey is DJZLQKQOUAWJRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4S/c1-5-8(13-12-11-5)7(10-9)6-3-2-4-6/h6-7,10H,2-4,9H2,1H3.
What are the key properties of [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine?
[cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine has a molecular weight of 198.29 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105340044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).