11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane

C17H22N4OS — CID 118739514

IUPAC11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane
SMILESc1ccc(N2CCOCC3(CCCN(c4nccs4)C3)C2)nc1
InChIInChI=1S/C17H22N4OS/c1-2-6-18-15(4-1)20-9-10-22-14-17(12-20)5-3-8-21(13-17)16-19-7-11-23-16/h1-2,4,6-7,11H,3,5,8-10,12-14H2
InChIKeyZTQLGDMCIOOBTQ-UHFFFAOYSA-N
MW330.46 g/mol
LogP2.66
Rot. Bonds2

About 11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane

11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane (PubChem CID 118739514) has the molecular formula C17H22N4OS and a molecular weight of 330.46 g/mol. Its IUPAC name is 11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane.

Molecular Properties

Compound Name11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane
PubChem CID118739514
Molecular FormulaC17H22N4OS
Molecular Weight330.46 g/mol
Exact Mass330.15
IUPAC Name11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane
SMILESc1ccc(N2CCOCC3(CCCN(c4nccs4)C3)C2)nc1
InChIInChI=1S/C17H22N4OS/c1-2-6-18-15(4-1)20-9-10-22-14-17(12-20)5-3-8-21(13-17)16-19-7-11-23-16/h1-2,4,6-7,11H,3,5,8-10,12-14H2
InChIKeyZTQLGDMCIOOBTQ-UHFFFAOYSA-N
XLogP2.66
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.46
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane with MolForge

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Related Compounds

2-{[5-(Morpholin-4-ylmethyl)pyridin-2-yl]amino}-1,3-thiazole-5-carbonitrile
CID 25093342
3-(6-Methylpyridazin-3-yl)-11-(1,3-thiazol-2-yl)-8-oxa-3,11-diazaspiro[5.6]dodecane
CID 97399502
2-(Pyridin-3-ylmethyl)-11-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 118740917
2-Pyridin-2-yl-11-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 118744203
11-(3-Fluoro-2-pyridinyl)-2-(1,3,4-thiadiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 118745238
2-Pyridin-2-yl-10-(thiophen-2-ylmethyl)-7-oxa-2,10-diazaspiro[4.6]undecane
CID 118745590
10-[(2-Methyl-1,3-thiazol-4-yl)methyl]-2-pyridin-2-yl-7-oxa-2,10-diazaspiro[4.6]undecane
CID 118746212
2-(6-Methylpyridazin-3-yl)-11-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 118746411
11-Pyrimidin-2-yl-2-(thiophen-2-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 118746651
2-methyl-4-[[4-(oxolan-3-yl)-3,5-dihydro-2H-pyrido[2,3-e][1,4]diazepin-1-yl]methyl]-1,3-thiazole
CID 118747009
1-(2-morpholin-4-ylpyridin-3-yl)-N-(tetrahydrofuran-2-ylmethyl)-N-(3-thienylmethyl)methanamine
CID 46999324
N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-1,3-thiazol-2-amine
CID 75415757

Frequently Asked Questions

What is the IUPAC name of 11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
The IUPAC name of 11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane (CID 118739514) is 11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane.
What is the SMILES notation for 11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
The canonical SMILES for 11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane is c1ccc(N2CCOCC3(CCCN(c4nccs4)C3)C2)nc1.
What is the InChIKey of 11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
The InChIKey is ZTQLGDMCIOOBTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4OS/c1-2-6-18-15(4-1)20-9-10-22-14-17(12-20)5-3-8-21(13-17)16-19-7-11-23-16/h1-2,4,6-7,11H,3,5,8-10,12-14H2.
What are the key properties of 11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane has a molecular weight of 330.46 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 11-pyridin-2-yl-2-(1,3-thiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane is sourced from PubChem (CID 118739514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).