2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene

C8H14N2 — CID 89167178

IUPAC2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene
SMILES[H]/N=N/CC[C@@H]1CC=CCC1
InChIInChI=1S/C8H14N2/c9-10-7-6-8-4-2-1-3-5-8/h1-2,8-9H,3-7H2/b10-9+/t8-/m1/s1
InChIKeyYDZUACHBLYYYHF-KGSKPCQNSA-N
MW138.21 g/mol
LogP2.76
Rot. Bonds3

About 2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene

2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene (PubChem CID 89167178) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene.

Molecular Properties

Compound Name2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene
PubChem CID89167178
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene
SMILES[H]/N=N/CC[C@@H]1CC=CCC1
InChIInChI=1S/C8H14N2/c9-10-7-6-8-4-2-1-3-5-8/h1-2,8-9H,3-7H2/b10-9+/t8-/m1/s1
InChIKeyYDZUACHBLYYYHF-KGSKPCQNSA-N
XLogP2.76
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene?
The IUPAC name of 2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene (CID 89167178) is 2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene.
What is the SMILES notation for 2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene?
The canonical SMILES for 2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene is [H]/N=N/CC[C@@H]1CC=CCC1.
What is the InChIKey of 2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene?
The InChIKey is YDZUACHBLYYYHF-KGSKPCQNSA-N. The full InChI is InChI=1S/C8H14N2/c9-10-7-6-8-4-2-1-3-5-8/h1-2,8-9H,3-7H2/b10-9+/t8-/m1/s1.
What are the key properties of 2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene?
2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene has a molecular weight of 138.21 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1S)-cyclohex-3-en-1-yl]ethyldiazene is sourced from PubChem (CID 89167178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).