ethane;3-methyl-8-thiaspiro[4.5]decane

C12H24S — CID 144515809

IUPACethane;3-methyl-8-thiaspiro[4.5]decane
SMILESCC.CC1CCC2(CCSCC2)C1
InChIInChI=1S/C10H18S.C2H6/c1-9-2-3-10(8-9)4-6-11-7-5-10;1-2/h9H,2-8H2,1H3;1-2H3
InChIKeyDZNVSQGRHAJTRV-UHFFFAOYSA-N
MW200.39 g/mol
LogP4.35
Rot. Bonds

About ethane;3-methyl-8-thiaspiro[4.5]decane

ethane;3-methyl-8-thiaspiro[4.5]decane (PubChem CID 144515809) has the molecular formula C12H24S and a molecular weight of 200.39 g/mol. Its IUPAC name is ethane;3-methyl-8-thiaspiro[4.5]decane.

Molecular Properties

Compound Nameethane;3-methyl-8-thiaspiro[4.5]decane
PubChem CID144515809
Molecular FormulaC12H24S
Molecular Weight200.39 g/mol
Exact Mass200.16
IUPAC Nameethane;3-methyl-8-thiaspiro[4.5]decane
SMILESCC.CC1CCC2(CCSCC2)C1
InChIInChI=1S/C10H18S.C2H6/c1-9-2-3-10(8-9)4-6-11-7-5-10;1-2/h9H,2-8H2,1H3;1-2H3
InChIKeyDZNVSQGRHAJTRV-UHFFFAOYSA-N
XLogP4.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.39
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3,8-dimethylspiro[4.4]nonane;ethane
CID 178108265
ethane;3-methylspiro[4.4]nonane
CID 168995417
(3R,8R)-3,8-dimethylspiro[4.4]nonane
CID 171400850
2,7-dimethylspiro[3.4]octane
CID 142902956
(3R)-3-methylspiro[4.5]decane
CID 140778087
3,8-dimethyl-8-azaspiro[4.5]decane
CID 22975666
ethane;6-methylspiro[2.5]octane
CID 142110397
3-iodo-8-methylspiro[4.4]nonane
CID 154690645
3,9-dimethylspiro[5.5]undecane
CID 20825106
(3S)-1,1-difluoro-3-methylcyclopentane
CID 59434161
6-methyl-1-thiaspiro[3.4]octane
CID 130381704
(7R)-7-methyl-2-propylspiro[3.4]octane
CID 167622159

Frequently Asked Questions

What is the IUPAC name of ethane;3-methyl-8-thiaspiro[4.5]decane?
The IUPAC name of ethane;3-methyl-8-thiaspiro[4.5]decane (CID 144515809) is ethane;3-methyl-8-thiaspiro[4.5]decane.
What is the SMILES notation for ethane;3-methyl-8-thiaspiro[4.5]decane?
The canonical SMILES for ethane;3-methyl-8-thiaspiro[4.5]decane is CC.CC1CCC2(CCSCC2)C1.
What is the InChIKey of ethane;3-methyl-8-thiaspiro[4.5]decane?
The InChIKey is DZNVSQGRHAJTRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18S.C2H6/c1-9-2-3-10(8-9)4-6-11-7-5-10;1-2/h9H,2-8H2,1H3;1-2H3.
What are the key properties of ethane;3-methyl-8-thiaspiro[4.5]decane?
ethane;3-methyl-8-thiaspiro[4.5]decane has a molecular weight of 200.39 g/mol, XLogP of 4.35, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-methyl-8-thiaspiro[4.5]decane is sourced from PubChem (CID 144515809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).