9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione

C14H18N2O2S — CID 64969579

IUPAC9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCC(c1ccsc1)N1CC(=O)NC2(CCCC2)C1=O
InChIInChI=1S/C14H18N2O2S/c1-10(11-4-7-19-9-11)16-8-12(17)15-14(13(16)18)5-2-3-6-14/h4,7,9-10H,2-3,5-6,8H2,1H3,(H,15,17)
InChIKeyNEBXMIZKSDIOKK-UHFFFAOYSA-N
MW278.38 g/mol
LogP2.08
Rot. Bonds2

About 9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione

9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione (PubChem CID 64969579) has the molecular formula C14H18N2O2S and a molecular weight of 278.38 g/mol. Its IUPAC name is 9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione.

Molecular Properties

Compound Name9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
PubChem CID64969579
Molecular FormulaC14H18N2O2S
Molecular Weight278.38 g/mol
Exact Mass278.11
IUPAC Name9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCC(c1ccsc1)N1CC(=O)NC2(CCCC2)C1=O
InChIInChI=1S/C14H18N2O2S/c1-10(11-4-7-19-9-11)16-8-12(17)15-14(13(16)18)5-2-3-6-14/h4,7,9-10H,2-3,5-6,8H2,1H3,(H,15,17)
InChIKeyNEBXMIZKSDIOKK-UHFFFAOYSA-N
XLogP2.08
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.38
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione with MolForge

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Related Compounds

9-(1-phenylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64957690
3,3-diethyl-1-(1-thiophen-3-ylethyl)piperazine-2,5-dione
CID 64969673
9-(1-thiophen-2-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64963817
9-[1-(3-chlorophenyl)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64965352
4-[1-(5-chlorothiophen-2-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64964900
4-(1-cyclopropylpropan-2-yl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64971995
1-(1-thiophen-3-ylethyl)pyrrolidine-2,3-dione
CID 62841900
9-(1-thiophen-2-ylbutyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64966321
2,2-dimethyl-4-[(1S)-1-phenylethyl]-1,4-diazaspiro[5.5]undecan-5-one
CID 15350128
10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 64882632
9-(1-cyclohexylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64969194
9-tert-butyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64956090

Frequently Asked Questions

What is the IUPAC name of 9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The IUPAC name of 9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione (CID 64969579) is 9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione.
What is the SMILES notation for 9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The canonical SMILES for 9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione is CC(c1ccsc1)N1CC(=O)NC2(CCCC2)C1=O.
What is the InChIKey of 9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The InChIKey is NEBXMIZKSDIOKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2S/c1-10(11-4-7-19-9-11)16-8-12(17)15-14(13(16)18)5-2-3-6-14/h4,7,9-10H,2-3,5-6,8H2,1H3,(H,15,17).
What are the key properties of 9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione has a molecular weight of 278.38 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(1-thiophen-3-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione is sourced from PubChem (CID 64969579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).