2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol

C8H11NO2S — CID 130501398

IUPAC2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol
SMILESCOC1(c2nc(O)cs2)CCC1
InChIInChI=1S/C8H11NO2S/c1-11-8(3-2-4-8)7-9-6(10)5-12-7/h5,10H,2-4H2,1H3
InChIKeyNRKKOOGTPMIITR-UHFFFAOYSA-N
MW185.25 g/mol
LogP1.87
Rot. Bonds2

About 2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol

2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol (PubChem CID 130501398) has the molecular formula C8H11NO2S and a molecular weight of 185.25 g/mol. Its IUPAC name is 2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol.

Molecular Properties

Compound Name2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol
PubChem CID130501398
Molecular FormulaC8H11NO2S
Molecular Weight185.25 g/mol
Exact Mass185.05
IUPAC Name2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol
SMILESCOC1(c2nc(O)cs2)CCC1
InChIInChI=1S/C8H11NO2S/c1-11-8(3-2-4-8)7-9-6(10)5-12-7/h5,10H,2-4H2,1H3
InChIKeyNRKKOOGTPMIITR-UHFFFAOYSA-N
XLogP1.87
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.25
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Cyclobutyl-1,3-thiazol-4-ol;methane
CID 20084335
2-Cyclobutyl-4-thiazolol
CID 20084336
2-(4-Methoxyoxan-4-yl)-1,3-thiazol-4-ol
CID 126975841
2-(1-Methoxypropyl)-1,3-thiazol-4-ol
CID 126975848
2-(2-Methyloxolan-2-yl)-1,3-thiazol-4-ol
CID 130501337
2-(2-Ethoxypropan-2-yl)-1,3-thiazol-4-ol
CID 130501344
2-[Cyclopropyl(methoxy)methyl]-1,3-thiazol-4-ol
CID 130501378
2-(1-Ethoxyethyl)-1,3-thiazol-4-ol
CID 130501410
2-(1-Ethoxycyclohexyl)-1,3-thiazol-4-ol
CID 130501487
2-(1-Methoxycyclopentyl)-1,3-thiazol-4-ol
CID 130501532
2-(1-Methoxy-4-methylcyclohexyl)-1,3-thiazol-4-ol
CID 130501533

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol?
The IUPAC name of 2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol (CID 130501398) is 2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol.
What is the SMILES notation for 2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol?
The canonical SMILES for 2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol is COC1(c2nc(O)cs2)CCC1.
What is the InChIKey of 2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol?
The InChIKey is NRKKOOGTPMIITR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2S/c1-11-8(3-2-4-8)7-9-6(10)5-12-7/h5,10H,2-4H2,1H3.
What are the key properties of 2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol?
2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol has a molecular weight of 185.25 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxycyclobutyl)-1,3-thiazol-4-ol is sourced from PubChem (CID 130501398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).