8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane

C10H19NS — CID 170523768

IUPAC8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane
SMILESCC(C)N1CCSC2(CCC2)C1
InChIInChI=1S/C10H19NS/c1-9(2)11-6-7-12-10(8-11)4-3-5-10/h9H,3-8H2,1-2H3
InChIKeySCHVSFGSAKVQBS-UHFFFAOYSA-N
MW185.34 g/mol
LogP2.37
Rot. Bonds1

About 8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane

8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane (PubChem CID 170523768) has the molecular formula C10H19NS and a molecular weight of 185.34 g/mol. Its IUPAC name is 8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane.

Molecular Properties

Compound Name8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane
PubChem CID170523768
Molecular FormulaC10H19NS
Molecular Weight185.34 g/mol
Exact Mass185.12
IUPAC Name8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane
SMILESCC(C)N1CCSC2(CCC2)C1
InChIInChI=1S/C10H19NS/c1-9(2)11-6-7-12-10(8-11)4-3-5-10/h9H,3-8H2,1-2H3
InChIKeySCHVSFGSAKVQBS-UHFFFAOYSA-N
XLogP2.37
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 ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(r,s)-3-Isopropylsulfanyl-1-methyl-piperidine
CID 15063103
3-Ethyl-2,4-dimethylthiomorpholine
CID 12517922
2-Methyl-3.4-diathyl-thiomorpholin
CID 12517923
3-Ethylsulfanyl-1-methylpiperidine
CID 15063101
(r,s)-3-Ethylsulfanyl-1-methyl-piperidine
CID 15063102
(3R)-1-methyl-3-propan-2-ylsulfanylpiperidine
CID 15063104
1-[2-(2-Methylpropylsulfanyl)ethyl]piperidine
CID 13668932
1-Methyl-4-propylsulfanylpiperidine
CID 18723000
4-Butylsulfanyl-1-methylpiperidine
CID 18723236
4-Ethylsulfanyl-1-methylpiperidine
CID 18723254
1-(4-Ethylsulfanylbutyl)piperidine
CID 18965256
1-[5-(3-Methylbutylsulfanyl)pentyl]piperidine
CID 18965262

Frequently Asked Questions

What is the IUPAC name of 8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane?
The IUPAC name of 8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane (CID 170523768) is 8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane.
What is the SMILES notation for 8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane?
The canonical SMILES for 8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane is CC(C)N1CCSC2(CCC2)C1.
What is the InChIKey of 8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane?
The InChIKey is SCHVSFGSAKVQBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NS/c1-9(2)11-6-7-12-10(8-11)4-3-5-10/h9H,3-8H2,1-2H3.
What are the key properties of 8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane?
8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane has a molecular weight of 185.34 g/mol, XLogP of 2.37, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propan-2-yl-5-thia-8-azaspiro[3.5]nonane is sourced from PubChem (CID 170523768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).