ethane;8-thia-2-azaspiro[4.5]decane

C10H21NS — CID 145416376

IUPACethane;8-thia-2-azaspiro[4.5]decane
SMILESC1CC2(CCSCC2)CN1.CC
InChIInChI=1S/C8H15NS.C2H6/c1-4-9-7-8(1)2-5-10-6-3-8;1-2/h9H,1-7H2;1-2H3
InChIKeyANGLYSSUUJGOSR-UHFFFAOYSA-N
MW187.35 g/mol
LogP2.52
Rot. Bonds

About ethane;8-thia-2-azaspiro[4.5]decane

ethane;8-thia-2-azaspiro[4.5]decane (PubChem CID 145416376) has the molecular formula C10H21NS and a molecular weight of 187.35 g/mol. Its IUPAC name is ethane;8-thia-2-azaspiro[4.5]decane.

Molecular Properties

Compound Nameethane;8-thia-2-azaspiro[4.5]decane
PubChem CID145416376
Molecular FormulaC10H21NS
Molecular Weight187.35 g/mol
Exact Mass187.14
IUPAC Nameethane;8-thia-2-azaspiro[4.5]decane
SMILESC1CC2(CCSCC2)CN1.CC
InChIInChI=1S/C8H15NS.C2H6/c1-4-9-7-8(1)2-5-10-6-3-8;1-2/h9H,1-7H2;1-2H3
InChIKeyANGLYSSUUJGOSR-UHFFFAOYSA-N
XLogP2.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.35
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;8-thia-2-azaspiro[4.5]decane?
The IUPAC name of ethane;8-thia-2-azaspiro[4.5]decane (CID 145416376) is ethane;8-thia-2-azaspiro[4.5]decane.
What is the SMILES notation for ethane;8-thia-2-azaspiro[4.5]decane?
The canonical SMILES for ethane;8-thia-2-azaspiro[4.5]decane is C1CC2(CCSCC2)CN1.CC.
What is the InChIKey of ethane;8-thia-2-azaspiro[4.5]decane?
The InChIKey is ANGLYSSUUJGOSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NS.C2H6/c1-4-9-7-8(1)2-5-10-6-3-8;1-2/h9H,1-7H2;1-2H3.
What are the key properties of ethane;8-thia-2-azaspiro[4.5]decane?
ethane;8-thia-2-azaspiro[4.5]decane has a molecular weight of 187.35 g/mol, XLogP of 2.52, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;8-thia-2-azaspiro[4.5]decane is sourced from PubChem (CID 145416376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).