(8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene

C9H15N — CID 130224141

IUPAC(8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene
SMILESC[C@@H]1CN(C)C=CC12CC2
InChIInChI=1S/C9H15N/c1-8-7-10(2)6-5-9(8)3-4-9/h5-6,8H,3-4,7H2,1-2H3/t8-/m1/s1
InChIKeyULCHVSYUHSPFOX-MRVPVSSYSA-N
MW137.23 g/mol
LogP1.86
Rot. Bonds

About (8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene

(8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene (PubChem CID 130224141) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is (8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene.

Molecular Properties

Compound Name(8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene
PubChem CID130224141
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name(8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene
SMILESC[C@@H]1CN(C)C=CC12CC2
InChIInChI=1S/C9H15N/c1-8-7-10(2)6-5-9(8)3-4-9/h5-6,8H,3-4,7H2,1-2H3/t8-/m1/s1
InChIKeyULCHVSYUHSPFOX-MRVPVSSYSA-N
XLogP1.86
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene?
The IUPAC name of (8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene (CID 130224141) is (8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene.
What is the SMILES notation for (8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene?
The canonical SMILES for (8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene is C[C@@H]1CN(C)C=CC12CC2.
What is the InChIKey of (8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene?
The InChIKey is ULCHVSYUHSPFOX-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H15N/c1-8-7-10(2)6-5-9(8)3-4-9/h5-6,8H,3-4,7H2,1-2H3/t8-/m1/s1.
What are the key properties of (8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene?
(8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene has a molecular weight of 137.23 g/mol, XLogP of 1.86, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (8S)-6,8-dimethyl-6-azaspiro[2.5]oct-4-ene is sourced from PubChem (CID 130224141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).