8-ethyl-2-thia-8-azaspiro[4.5]decane

C10H19NS — CID 130137854

IUPAC8-ethyl-2-thia-8-azaspiro[4.5]decane
SMILESCCN1CCC2(CCSC2)CC1
InChIInChI=1S/C10H19NS/c1-2-11-6-3-10(4-7-11)5-8-12-9-10/h2-9H2,1H3
InChIKeyVTJXWZIMUHZWHV-UHFFFAOYSA-N
MW185.34 g/mol
LogP2.23
Rot. Bonds1

About 8-ethyl-2-thia-8-azaspiro[4.5]decane

8-ethyl-2-thia-8-azaspiro[4.5]decane (PubChem CID 130137854) has the molecular formula C10H19NS and a molecular weight of 185.34 g/mol. Its IUPAC name is 8-ethyl-2-thia-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name8-ethyl-2-thia-8-azaspiro[4.5]decane
PubChem CID130137854
Molecular FormulaC10H19NS
Molecular Weight185.34 g/mol
Exact Mass185.12
IUPAC Name8-ethyl-2-thia-8-azaspiro[4.5]decane
SMILESCCN1CCC2(CCSC2)CC1
InChIInChI=1S/C10H19NS/c1-2-11-6-3-10(4-7-11)5-8-12-9-10/h2-9H2,1H3
InChIKeyVTJXWZIMUHZWHV-UHFFFAOYSA-N
XLogP2.23
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.34
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-ethyl-2-thia-8-azaspiro[4.5]decane?
The IUPAC name of 8-ethyl-2-thia-8-azaspiro[4.5]decane (CID 130137854) is 8-ethyl-2-thia-8-azaspiro[4.5]decane.
What is the SMILES notation for 8-ethyl-2-thia-8-azaspiro[4.5]decane?
The canonical SMILES for 8-ethyl-2-thia-8-azaspiro[4.5]decane is CCN1CCC2(CCSC2)CC1.
What is the InChIKey of 8-ethyl-2-thia-8-azaspiro[4.5]decane?
The InChIKey is VTJXWZIMUHZWHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NS/c1-2-11-6-3-10(4-7-11)5-8-12-9-10/h2-9H2,1H3.
What are the key properties of 8-ethyl-2-thia-8-azaspiro[4.5]decane?
8-ethyl-2-thia-8-azaspiro[4.5]decane has a molecular weight of 185.34 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-2-thia-8-azaspiro[4.5]decane is sourced from PubChem (CID 130137854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).