(5R)-1-azaspiro[4.4]non-8-ene

C8H13N — CID 130924193

IUPAC(5R)-1-azaspiro[4.4]non-8-ene
SMILESC1=C[C@@]2(CC1)CCCN2
InChIInChI=1S/C8H13N/c1-2-5-8(4-1)6-3-7-9-8/h1,4,9H,2-3,5-7H2/t8-/m1/s1
InChIKeyMFYPUDHVTGBEJY-MRVPVSSYSA-N
MW123.20 g/mol
LogP1.46
Rot. Bonds

About (5R)-1-azaspiro[4.4]non-8-ene

(5R)-1-azaspiro[4.4]non-8-ene (PubChem CID 130924193) has the molecular formula C8H13N and a molecular weight of 123.20 g/mol. Its IUPAC name is (5R)-1-azaspiro[4.4]non-8-ene.

Molecular Properties

Compound Name(5R)-1-azaspiro[4.4]non-8-ene
PubChem CID130924193
Molecular FormulaC8H13N
Molecular Weight123.20 g/mol
Exact Mass123.10
IUPAC Name(5R)-1-azaspiro[4.4]non-8-ene
SMILESC1=C[C@@]2(CC1)CCCN2
InChIInChI=1S/C8H13N/c1-2-5-8(4-1)6-3-7-9-8/h1,4,9H,2-3,5-7H2/t8-/m1/s1
InChIKeyMFYPUDHVTGBEJY-MRVPVSSYSA-N
XLogP1.46
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.20
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (5R)-1-azaspiro[4.4]non-8-ene?
The IUPAC name of (5R)-1-azaspiro[4.4]non-8-ene (CID 130924193) is (5R)-1-azaspiro[4.4]non-8-ene.
What is the SMILES notation for (5R)-1-azaspiro[4.4]non-8-ene?
The canonical SMILES for (5R)-1-azaspiro[4.4]non-8-ene is C1=C[C@@]2(CC1)CCCN2.
What is the InChIKey of (5R)-1-azaspiro[4.4]non-8-ene?
The InChIKey is MFYPUDHVTGBEJY-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H13N/c1-2-5-8(4-1)6-3-7-9-8/h1,4,9H,2-3,5-7H2/t8-/m1/s1.
What are the key properties of (5R)-1-azaspiro[4.4]non-8-ene?
(5R)-1-azaspiro[4.4]non-8-ene has a molecular weight of 123.20 g/mol, XLogP of 1.46, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-1-azaspiro[4.4]non-8-ene is sourced from PubChem (CID 130924193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).