5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole

C12H19NOS — CID 151198824

IUPAC5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole
SMILESCC(OC1(C)CCCCC1)c1cncs1
InChIInChI=1S/C12H19NOS/c1-10(11-8-13-9-15-11)14-12(2)6-4-3-5-7-12/h8-10H,3-7H2,1-2H3
InChIKeyNHWVWUOPPLVEJI-UHFFFAOYSA-N
MW225.36 g/mol
LogP3.94
Rot. Bonds3

About 5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole

5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole (PubChem CID 151198824) has the molecular formula C12H19NOS and a molecular weight of 225.36 g/mol. Its IUPAC name is 5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole.

Molecular Properties

Compound Name5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole
PubChem CID151198824
Molecular FormulaC12H19NOS
Molecular Weight225.36 g/mol
Exact Mass225.12
IUPAC Name5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole
SMILESCC(OC1(C)CCCCC1)c1cncs1
InChIInChI=1S/C12H19NOS/c1-10(11-8-13-9-15-11)14-12(2)6-4-3-5-7-12/h8-10H,3-7H2,1-2H3
InChIKeyNHWVWUOPPLVEJI-UHFFFAOYSA-N
XLogP3.94
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-Ethoxypropan-2-yl)-2-methylsulfanyl-1,3-thiazole
CID 18996079
4-(2-Chlorothiazol-5-yl)-4-methoxy-2,2-dimethyltetrahydropyran
CID 18998778
(2S,4R)-4-(2-chlorothiazol-5-yl)-4-methoxy-2-methyltetrahydropyran
CID 53885938
5-[2-(1-Methylcyclohexyl)oxiran-2-yl]-1,3-thiazole
CID 58079292
5-(2-Methoxypropan-2-yl)thiazole
CID 132019980
2-Chloro-5-(4-methoxy-2-methyloxan-2-yl)-1,3-thiazole
CID 140969926
5-[1-[(2-Methylpropan-2-yl)oxy]ethyl]-1,3-thiazole
CID 150077774
2-Bromo-5-[2-(2,2-dimethyldodecan-3-yloxy)propan-2-yl]-1,3-thiazole
CID 151186366
5-Propan-2-yl-2-(2-propan-2-yloxycyclohexyl)-1,3-thiazole
CID 160371218
5-(1-Methoxy-3-methylbutyl)-1,3-thiazole
CID 171505801
5-(2-Tert-butyloxan-2-yl)-1,3-thiazole
CID 172705526
2-Chloro-5-(5-methyloxolan-2-yl)-1,3-thiazole
CID 173093773

Frequently Asked Questions

What is the IUPAC name of 5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole?
The IUPAC name of 5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole (CID 151198824) is 5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole.
What is the SMILES notation for 5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole?
The canonical SMILES for 5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole is CC(OC1(C)CCCCC1)c1cncs1.
What is the InChIKey of 5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole?
The InChIKey is NHWVWUOPPLVEJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NOS/c1-10(11-8-13-9-15-11)14-12(2)6-4-3-5-7-12/h8-10H,3-7H2,1-2H3.
What are the key properties of 5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole?
5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole has a molecular weight of 225.36 g/mol, XLogP of 3.94, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(1-methylcyclohexyl)oxyethyl]-1,3-thiazole is sourced from PubChem (CID 151198824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).