[3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine

C14H18N4O — CID 55181346

IUPAC[3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine
SMILESNNc1nc(C2(c3ccccc3)CCCCC2)no1
InChIInChI=1S/C14H18N4O/c15-17-13-16-12(18-19-13)14(9-5-2-6-10-14)11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10,15H2,(H,16,17,18)
InChIKeyPVPUYRDMZSKOPJ-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.61
Rot. Bonds3

About [3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine

[3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine (PubChem CID 55181346) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is [3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine.

Molecular Properties

Compound Name[3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine
PubChem CID55181346
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name[3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine
SMILESNNc1nc(C2(c3ccccc3)CCCCC2)no1
InChIInChI=1S/C14H18N4O/c15-17-13-16-12(18-19-13)14(9-5-2-6-10-14)11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10,15H2,(H,16,17,18)
InChIKeyPVPUYRDMZSKOPJ-UHFFFAOYSA-N
XLogP2.61
TPSA76.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.61
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 [3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine?
The IUPAC name of [3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine (CID 55181346) is [3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine.
What is the SMILES notation for [3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine?
The canonical SMILES for [3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine is NNc1nc(C2(c3ccccc3)CCCCC2)no1.
What is the InChIKey of [3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine?
The InChIKey is PVPUYRDMZSKOPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c15-17-13-16-12(18-19-13)14(9-5-2-6-10-14)11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10,15H2,(H,16,17,18).
What are the key properties of [3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine?
[3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine has a molecular weight of 258.32 g/mol, XLogP of 2.61, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]hydrazine is sourced from PubChem (CID 55181346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).