[4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine

C11H20N4OS — CID 64730255

IUPAC[4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine
SMILESCC1CC(C)CC(OCc2nnsc2NN)C1
InChIInChI=1S/C11H20N4OS/c1-7-3-8(2)5-9(4-7)16-6-10-11(13-12)17-15-14-10/h7-9,13H,3-6,12H2,1-2H3
InChIKeySXJFAMWDWRXCQF-UHFFFAOYSA-N
MW256.37 g/mol
LogP2.16
Rot. Bonds4

About [4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine

[4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine (PubChem CID 64730255) has the molecular formula C11H20N4OS and a molecular weight of 256.37 g/mol. Its IUPAC name is [4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine.

Molecular Properties

Compound Name[4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine
PubChem CID64730255
Molecular FormulaC11H20N4OS
Molecular Weight256.37 g/mol
Exact Mass256.14
IUPAC Name[4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine
SMILESCC1CC(C)CC(OCc2nnsc2NN)C1
InChIInChI=1S/C11H20N4OS/c1-7-3-8(2)5-9(4-7)16-6-10-11(13-12)17-15-14-10/h7-9,13H,3-6,12H2,1-2H3
InChIKeySXJFAMWDWRXCQF-UHFFFAOYSA-N
XLogP2.16
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.37
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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 [4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine?
The IUPAC name of [4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine (CID 64730255) is [4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine.
What is the SMILES notation for [4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine?
The canonical SMILES for [4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine is CC1CC(C)CC(OCc2nnsc2NN)C1.
What is the InChIKey of [4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine?
The InChIKey is SXJFAMWDWRXCQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4OS/c1-7-3-8(2)5-9(4-7)16-6-10-11(13-12)17-15-14-10/h7-9,13H,3-6,12H2,1-2H3.
What are the key properties of [4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine?
[4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine has a molecular weight of 256.37 g/mol, XLogP of 2.16, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(3,5-dimethylcyclohexyl)oxymethyl]thiadiazol-5-yl]hydrazine is sourced from PubChem (CID 64730255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).