[cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine

C13H24N2O — CID 102650012

IUPAC[cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
SMILESNNC(C1=CCCCO1)C1CCCCCC1
InChIInChI=1S/C13H24N2O/c14-15-13(12-9-5-6-10-16-12)11-7-3-1-2-4-8-11/h9,11,13,15H,1-8,10,14H2
InChIKeyAUYZFCZSLILEEH-UHFFFAOYSA-N
MW224.35 g/mol
LogP2.48
Rot. Bonds3

About [cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine

[cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine (PubChem CID 102650012) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is [cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine.

Molecular Properties

Compound Name[cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
PubChem CID102650012
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name[cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
SMILESNNC(C1=CCCCO1)C1CCCCCC1
InChIInChI=1S/C13H24N2O/c14-15-13(12-9-5-6-10-16-12)11-7-3-1-2-4-8-11/h9,11,13,15H,1-8,10,14H2
InChIKeyAUYZFCZSLILEEH-UHFFFAOYSA-N
XLogP2.48
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 52.48
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(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine?
The IUPAC name of [cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine (CID 102650012) is [cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine.
What is the SMILES notation for [cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine?
The canonical SMILES for [cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine is NNC(C1=CCCCO1)C1CCCCCC1.
What is the InChIKey of [cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine?
The InChIKey is AUYZFCZSLILEEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c14-15-13(12-9-5-6-10-16-12)11-7-3-1-2-4-8-11/h9,11,13,15H,1-8,10,14H2.
What are the key properties of [cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine?
[cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine has a molecular weight of 224.35 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine is sourced from PubChem (CID 102650012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).