8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine

C9H18N2S — CID 135228318

IUPAC8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine
SMILESCN1CCC2(CC1)SCCC2N
InChIInChI=1S/C9H18N2S/c1-11-5-3-9(4-6-11)8(10)2-7-12-9/h8H,2-7,10H2,1H3
InChIKeyZEWJUDDSRHJLAC-UHFFFAOYSA-N
MW186.32 g/mol
LogP0.92
Rot. Bonds

About 8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine

8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine (PubChem CID 135228318) has the molecular formula C9H18N2S and a molecular weight of 186.32 g/mol. Its IUPAC name is 8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine.

Molecular Properties

Compound Name8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine
PubChem CID135228318
Molecular FormulaC9H18N2S
Molecular Weight186.32 g/mol
Exact Mass186.12
IUPAC Name8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine
SMILESCN1CCC2(CC1)SCCC2N
InChIInChI=1S/C9H18N2S/c1-11-5-3-9(4-6-11)8(10)2-7-12-9/h8H,2-7,10H2,1H3
InChIKeyZEWJUDDSRHJLAC-UHFFFAOYSA-N
XLogP0.92
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.32
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine?
The IUPAC name of 8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine (CID 135228318) is 8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine.
What is the SMILES notation for 8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine?
The canonical SMILES for 8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine is CN1CCC2(CC1)SCCC2N.
What is the InChIKey of 8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine?
The InChIKey is ZEWJUDDSRHJLAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2S/c1-11-5-3-9(4-6-11)8(10)2-7-12-9/h8H,2-7,10H2,1H3.
What are the key properties of 8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine?
8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine has a molecular weight of 186.32 g/mol, XLogP of 0.92, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-1-thia-8-azaspiro[4.5]decan-4-amine is sourced from PubChem (CID 135228318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).