8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane

C15H24N2S — CID 64842668

IUPAC8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane
SMILESCC1(C)CN(Cc2cccs2)C2(CCCC2)CN1
InChIInChI=1S/C15H24N2S/c1-14(2)12-17(10-13-6-5-9-18-13)15(11-16-14)7-3-4-8-15/h5-6,9,16H,3-4,7-8,10-12H2,1-2H3
InChIKeyADMJGYMURKHDCH-UHFFFAOYSA-N
MW264.44 g/mol
LogP3.24
Rot. Bonds2

About 8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane

8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane (PubChem CID 64842668) has the molecular formula C15H24N2S and a molecular weight of 264.44 g/mol. Its IUPAC name is 8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane
PubChem CID64842668
Molecular FormulaC15H24N2S
Molecular Weight264.44 g/mol
Exact Mass264.17
IUPAC Name8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane
SMILESCC1(C)CN(Cc2cccs2)C2(CCCC2)CN1
InChIInChI=1S/C15H24N2S/c1-14(2)12-17(10-13-6-5-9-18-13)15(11-16-14)7-3-4-8-15/h5-6,9,16H,3-4,7-8,10-12H2,1-2H3
InChIKeyADMJGYMURKHDCH-UHFFFAOYSA-N
XLogP3.24
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-2,5,5-trimethyl-1-(thiophen-2-ylmethyl)piperazine
CID 64840931
5-[(3,3-dimethyl-1,4-diazaspiro[5.5]undecan-1-yl)methyl]-1,3-thiazole
CID 112644875
3,3-dimethyl-4-(thiophen-2-ylmethyl)-1,4-diazaspiro[5.5]undecane
CID 64875517
8-cyclopropyl-8-methyl-6-(2-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane
CID 64861176
8-tert-butyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane
CID 64843223
2,2,5-trimethyl-5-phenyl-1-(thiophen-2-ylmethyl)piperazine
CID 64862496
2-ethyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine
CID 64846789
5-cyclopropyl-2-ethyl-2,5-dimethyl-1-(thiophen-2-ylmethyl)piperazine
CID 64876360
3,3,7-trimethyl-1-(thiophen-2-ylmethyl)-1,4-diazepane
CID 64869207
2-cyclopropyl-2-methyl-1-(thiophen-2-ylmethyl)piperazine
CID 64845627
3,3-dimethyl-1-[(2-methyltetrazol-5-yl)methyl]-1,4-diazaspiro[5.5]undecane
CID 107055594
5-[(8-cyclopropyl-8-methyl-6,9-diazaspiro[4.5]decan-6-yl)methyl]-1,3-thiazole
CID 115979600

Frequently Asked Questions

What is the IUPAC name of 8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
The IUPAC name of 8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane (CID 64842668) is 8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane is CC1(C)CN(Cc2cccs2)C2(CCCC2)CN1.
What is the InChIKey of 8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
The InChIKey is ADMJGYMURKHDCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2S/c1-14(2)12-17(10-13-6-5-9-18-13)15(11-16-14)7-3-4-8-15/h5-6,9,16H,3-4,7-8,10-12H2,1-2H3.
What are the key properties of 8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane has a molecular weight of 264.44 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8-dimethyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64842668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).