8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane

C18H28N2S — CID 64861176

IUPAC8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane
SMILESCC1(C2CC2)CN(CCc2cccs2)C2(CCCC2)CN1
InChIInChI=1S/C18H28N2S/c1-17(15-6-7-15)14-20(11-8-16-5-4-12-21-16)18(13-19-17)9-2-3-10-18/h4-5,12,15,19H,2-3,6-11,13-14H2,1H3
InChIKeyFUYOVMLQUOFGNZ-UHFFFAOYSA-N
MW304.50 g/mol
LogP3.68
Rot. Bonds4

About 8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane

8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane (PubChem CID 64861176) has the molecular formula C18H28N2S and a molecular weight of 304.50 g/mol. Its IUPAC name is 8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane
PubChem CID64861176
Molecular FormulaC18H28N2S
Molecular Weight304.50 g/mol
Exact Mass304.20
IUPAC Name8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane
SMILESCC1(C2CC2)CN(CCc2cccs2)C2(CCCC2)CN1
InChIInChI=1S/C18H28N2S/c1-17(15-6-7-15)14-20(11-8-16-5-4-12-21-16)18(13-19-17)9-2-3-10-18/h4-5,12,15,19H,2-3,6-11,13-14H2,1H3
InChIKeyFUYOVMLQUOFGNZ-UHFFFAOYSA-N
XLogP3.68
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.50
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclopropyl-2-ethyl-2,5-dimethyl-1-(2-thiophen-2-ylethyl)piperazine
CID 64878294
8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane
CID 64842668
5-cyclopropyl-2-ethyl-2,5-dimethyl-1-(thiophen-2-ylmethyl)piperazine
CID 64876360
5-[(8-cyclopropyl-8-methyl-6,9-diazaspiro[4.5]decan-6-yl)methyl]-1,3-thiazole
CID 115979600
3-cyclopropyl-1-(2-ethoxyethyl)-3-methyl-1,4-diazaspiro[5.5]undecane
CID 64860793
8-cyclopropyl-8-methyl-6-[(1-methylpyrazol-4-yl)methyl]-6,9-diazaspiro[4.5]decane
CID 64860600
2-cyclopropyl-2,5,5-trimethyl-1-(thiophen-2-ylmethyl)piperazine
CID 64840931
2,2-dimethyl-1-(2-thiophen-2-ylethyl)piperazine
CID 63774564
2,2,5-trimethyl-1-(2-thiophen-2-ylethyl)piperazine
CID 64845507
8-tert-butyl-9-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane
CID 64878537
2-cyclopropyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine
CID 64845627
3,3-dimethyl-4-(thiophen-2-ylmethyl)-1,4-diazaspiro[5.5]undecane
CID 64875517

Frequently Asked Questions

What is the IUPAC name of 8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane?
The IUPAC name of 8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane (CID 64861176) is 8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane is CC1(C2CC2)CN(CCc2cccs2)C2(CCCC2)CN1.
What is the InChIKey of 8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane?
The InChIKey is FUYOVMLQUOFGNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2S/c1-17(15-6-7-15)14-20(11-8-16-5-4-12-21-16)18(13-19-17)9-2-3-10-18/h4-5,12,15,19H,2-3,6-11,13-14H2,1H3.
What are the key properties of 8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane?
8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane has a molecular weight of 304.50 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64861176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).