11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione

C14H19N3O2S — CID 64965803

IUPAC11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione
SMILESO=C1CCN(Cc2nccs2)C(=O)C2(CCCCC2)N1
InChIInChI=1S/C14H19N3O2S/c18-11-4-8-17(10-12-15-7-9-20-12)13(19)14(16-11)5-2-1-3-6-14/h7,9H,1-6,8,10H2,(H,16,18)
InChIKeyGEWOJJGDEBSVAM-UHFFFAOYSA-N
MW293.39 g/mol
LogP1.69
Rot. Bonds2

About 11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione

11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione (PubChem CID 64965803) has the molecular formula C14H19N3O2S and a molecular weight of 293.39 g/mol. Its IUPAC name is 11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione.

Molecular Properties

Compound Name11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione
PubChem CID64965803
Molecular FormulaC14H19N3O2S
Molecular Weight293.39 g/mol
Exact Mass293.12
IUPAC Name11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione
SMILESO=C1CCN(Cc2nccs2)C(=O)C2(CCCCC2)N1
InChIInChI=1S/C14H19N3O2S/c18-11-4-8-17(10-12-15-7-9-20-12)13(19)14(16-11)5-2-1-3-6-14/h7,9H,1-6,8,10H2,(H,16,18)
InChIKeyGEWOJJGDEBSVAM-UHFFFAOYSA-N
XLogP1.69
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione with MolForge

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Related Compounds

10-(1,3-thiazol-2-ylmethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 64965758
11-[(4-methyl-1,3-thiazol-2-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 64966399
10-[(5-bromo-2-pyridinyl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 104812836
11-[(5-methyl-1,2-oxazol-3-yl)methyl]-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 64967825
11-(2-pyrazol-1-ylethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 64882771
10-[(5-ethylthiophen-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 64882245
11-propyl-7,11-diazaspiro[5.6]dodecane-8,12-dione
CID 64883747
3-ethyl-4-(1,3-thiazol-2-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64965781
10-[(3-methyl-1,2-oxazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 64968278
4-(pyrimidin-2-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64878815
10-(2-thiophen-3-ylethyl)-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 64882632
10-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 106377160

Frequently Asked Questions

What is the IUPAC name of 11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione?
The IUPAC name of 11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione (CID 64965803) is 11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione.
What is the SMILES notation for 11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione?
The canonical SMILES for 11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione is O=C1CCN(Cc2nccs2)C(=O)C2(CCCCC2)N1.
What is the InChIKey of 11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione?
The InChIKey is GEWOJJGDEBSVAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2S/c18-11-4-8-17(10-12-15-7-9-20-12)13(19)14(16-11)5-2-1-3-6-14/h7,9H,1-6,8,10H2,(H,16,18).
What are the key properties of 11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione?
11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione has a molecular weight of 293.39 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(1,3-thiazol-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane-8,12-dione is sourced from PubChem (CID 64965803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).