[cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine

C14H24N2O — CID 105330649

IUPAC[cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine
SMILESCc1cc(C(NN)C2CCCCCC2)c(C)o1
InChIInChI=1S/C14H24N2O/c1-10-9-13(11(2)17-10)14(16-15)12-7-5-3-4-6-8-12/h9,12,14,16H,3-8,15H2,1-2H3
InChIKeyLSNRXZILTMKHHO-UHFFFAOYSA-N
MW236.36 g/mol
LogP3.37
Rot. Bonds3

About [cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine

[cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine (PubChem CID 105330649) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is [cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine
PubChem CID105330649
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name[cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine
SMILESCc1cc(C(NN)C2CCCCCC2)c(C)o1
InChIInChI=1S/C14H24N2O/c1-10-9-13(11(2)17-10)14(16-15)12-7-5-3-4-6-8-12/h9,12,14,16H,3-8,15H2,1-2H3
InChIKeyLSNRXZILTMKHHO-UHFFFAOYSA-N
XLogP3.37
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 [cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine?
The IUPAC name of [cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine (CID 105330649) is [cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine.
What is the SMILES notation for [cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine?
The canonical SMILES for [cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine is Cc1cc(C(NN)C2CCCCCC2)c(C)o1.
What is the InChIKey of [cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine?
The InChIKey is LSNRXZILTMKHHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-10-9-13(11(2)17-10)14(16-15)12-7-5-3-4-6-8-12/h9,12,14,16H,3-8,15H2,1-2H3.
What are the key properties of [cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine?
[cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine has a molecular weight of 236.36 g/mol, XLogP of 3.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine is sourced from PubChem (CID 105330649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).