1-cycloheptyl-2-diazocycloheptane

C14H24N2 — CID 140510878

IUPAC1-cycloheptyl-2-diazocycloheptane
SMILES[N-]=[N+]=C1CCCCCC1C1CCCCCC1
InChIInChI=1S/C14H24N2/c15-16-14-11-7-3-6-10-13(14)12-8-4-1-2-5-9-12/h12-13H,1-11H2
InChIKeyPRAYPSDJYXGLAI-UHFFFAOYSA-N
MW220.36 g/mol
LogP4.21
Rot. Bonds1

About 1-cycloheptyl-2-diazocycloheptane

1-cycloheptyl-2-diazocycloheptane (PubChem CID 140510878) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 1-cycloheptyl-2-diazocycloheptane.

Molecular Properties

Compound Name1-cycloheptyl-2-diazocycloheptane
PubChem CID140510878
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name1-cycloheptyl-2-diazocycloheptane
SMILES[N-]=[N+]=C1CCCCCC1C1CCCCCC1
InChIInChI=1S/C14H24N2/c15-16-14-11-7-3-6-10-13(14)12-8-4-1-2-5-9-12/h12-13H,1-11H2
InChIKeyPRAYPSDJYXGLAI-UHFFFAOYSA-N
XLogP4.21
TPSA36.40 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-2-diazocycloheptane?
The IUPAC name of 1-cycloheptyl-2-diazocycloheptane (CID 140510878) is 1-cycloheptyl-2-diazocycloheptane.
What is the SMILES notation for 1-cycloheptyl-2-diazocycloheptane?
The canonical SMILES for 1-cycloheptyl-2-diazocycloheptane is [N-]=[N+]=C1CCCCCC1C1CCCCCC1.
What is the InChIKey of 1-cycloheptyl-2-diazocycloheptane?
The InChIKey is PRAYPSDJYXGLAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c15-16-14-11-7-3-6-10-13(14)12-8-4-1-2-5-9-12/h12-13H,1-11H2.
What are the key properties of 1-cycloheptyl-2-diazocycloheptane?
1-cycloheptyl-2-diazocycloheptane has a molecular weight of 220.36 g/mol, XLogP of 4.21, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-2-diazocycloheptane is sourced from PubChem (CID 140510878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).