2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole

C14H23N3S — CID 64939348

IUPAC2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole
SMILESCC1CNC2(CCCC2)CN1C(C)c1nccs1
InChIInChI=1S/C14H23N3S/c1-11-9-16-14(5-3-4-6-14)10-17(11)12(2)13-15-7-8-18-13/h7-8,11-12,16H,3-6,9-10H2,1-2H3
InChIKeyWJIWKSBFDRBMOG-UHFFFAOYSA-N
MW265.43 g/mol
LogP2.81
Rot. Bonds2

About 2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole

2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole (PubChem CID 64939348) has the molecular formula C14H23N3S and a molecular weight of 265.43 g/mol. Its IUPAC name is 2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole.

Molecular Properties

Compound Name2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole
PubChem CID64939348
Molecular FormulaC14H23N3S
Molecular Weight265.43 g/mol
Exact Mass265.16
IUPAC Name2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole
SMILESCC1CNC2(CCCC2)CN1C(C)c1nccs1
InChIInChI=1S/C14H23N3S/c1-11-9-16-14(5-3-4-6-14)10-17(11)12(2)13-15-7-8-18-13/h7-8,11-12,16H,3-6,9-10H2,1-2H3
InChIKeyWJIWKSBFDRBMOG-UHFFFAOYSA-N
XLogP2.81
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.43
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-4-propan-2-yl-1,4-diazaspiro[5.5]undecane
CID 64877989
3-methyl-4-[1-(5-methylfuran-2-yl)ethyl]-1,4-diazaspiro[5.5]undecane
CID 64947987
2-[1-(5-tert-butyl-2-methylpiperazin-1-yl)ethyl]-1,3-thiazole
CID 64939349
9-[1-(3-bromophenyl)ethyl]-8-methyl-6,9-diazaspiro[4.5]decane
CID 64946503
9-(1-cyclopropylethyl)-8-methyl-6,9-diazaspiro[4.5]decane
CID 64934634
2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole
CID 64942052
8-methyl-9-(2-methylpentan-3-yl)-6,9-diazaspiro[4.5]decane
CID 64947965
4-(3-ethylpentan-2-yl)-3-methyl-1,4-diazaspiro[5.5]undecane
CID 64941030
2-[1-(2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)ethyl]-1,3-thiazole
CID 66211376
2-[1-(2-ethylpiperazin-1-yl)ethyl]-1,3-thiazole
CID 64932333
4-[4-(furan-2-yl)butan-2-yl]-3-methyl-1,4-diazaspiro[5.5]undecane
CID 64947852
2-[1-(2-phenylpiperazin-1-yl)ethyl]-1,3-thiazole
CID 64932331

Frequently Asked Questions

What is the IUPAC name of 2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole?
The IUPAC name of 2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole (CID 64939348) is 2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole.
What is the SMILES notation for 2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole?
The canonical SMILES for 2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole is CC1CNC2(CCCC2)CN1C(C)c1nccs1.
What is the InChIKey of 2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole?
The InChIKey is WJIWKSBFDRBMOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3S/c1-11-9-16-14(5-3-4-6-14)10-17(11)12(2)13-15-7-8-18-13/h7-8,11-12,16H,3-6,9-10H2,1-2H3.
What are the key properties of 2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole?
2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole has a molecular weight of 265.43 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole is sourced from PubChem (CID 64939348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).