10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione

C15H20N2O2S — CID 64882632

IUPAC10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione
SMILESO=C1CCN(CCc2ccsc2)C(=O)C2(CCCC2)N1
InChIInChI=1S/C15H20N2O2S/c18-13-4-9-17(8-3-12-5-10-20-11-12)14(19)15(16-13)6-1-2-7-15/h5,10-11H,1-4,6-9H2,(H,16,18)
InChIKeyOHJIUASOJABQCH-UHFFFAOYSA-N
MW292.40 g/mol
LogP1.95
Rot. Bonds3

About 10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione

10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione (PubChem CID 64882632) has the molecular formula C15H20N2O2S and a molecular weight of 292.40 g/mol. Its IUPAC name is 10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione.

Molecular Properties

Compound Name10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione
PubChem CID64882632
Molecular FormulaC15H20N2O2S
Molecular Weight292.40 g/mol
Exact Mass292.12
IUPAC Name10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione
SMILESO=C1CCN(CCc2ccsc2)C(=O)C2(CCCC2)N1
InChIInChI=1S/C15H20N2O2S/c18-13-4-9-17(8-3-12-5-10-20-11-12)14(19)15(16-13)6-1-2-7-15/h5,10-11H,1-4,6-9H2,(H,16,18)
InChIKeyOHJIUASOJABQCH-UHFFFAOYSA-N
XLogP1.95
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,3-diethyl-1-(2-thiophen-3-ylethyl)-1,4-diazepane-2,5-dione
CID 64883852
11-propyl-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 64883747
10-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 106045858
11-(3,3-dimethylbutyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 64883163
11-but-3-ynyl-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 64972524
10-[2-(1,2,4-oxadiazol-3-yl)ethyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 106409683
10-(1,3-thiazol-2-ylmethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 64965758
11-pent-3-ynyl-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 116645589
10-[(5-ethylthiophen-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 64882245
11-(2-prop-2-ynylsulfanylethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 106432997
11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 64965803
11-(2-pyrazol-1-ylethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 64882771

Frequently Asked Questions

What is the IUPAC name of 10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione?
The IUPAC name of 10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione (CID 64882632) is 10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione.
What is the SMILES notation for 10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione?
The canonical SMILES for 10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione is O=C1CCN(CCc2ccsc2)C(=O)C2(CCCC2)N1.
What is the InChIKey of 10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione?
The InChIKey is OHJIUASOJABQCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2S/c18-13-4-9-17(8-3-12-5-10-20-11-12)14(19)15(16-13)6-1-2-7-15/h5,10-11H,1-4,6-9H2,(H,16,18).
What are the key properties of 10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione?
10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione has a molecular weight of 292.40 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione is sourced from PubChem (CID 64882632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).