3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol

C8H11NOS — CID 130604943

IUPAC3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol
SMILESCC1CC(O)(c2ccsn2)C1
InChIInChI=1S/C8H11NOS/c1-6-4-8(10,5-6)7-2-3-11-9-7/h2-3,6,10H,4-5H2,1H3
InChIKeyPQNGUWLSKDPCBT-UHFFFAOYSA-N
MW169.25 g/mol
LogP1.76
Rot. Bonds1

About 3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol

3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol (PubChem CID 130604943) has the molecular formula C8H11NOS and a molecular weight of 169.25 g/mol. Its IUPAC name is 3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol.

Molecular Properties

Compound Name3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol
PubChem CID130604943
Molecular FormulaC8H11NOS
Molecular Weight169.25 g/mol
Exact Mass169.06
IUPAC Name3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol
SMILESCC1CC(O)(c2ccsn2)C1
InChIInChI=1S/C8H11NOS/c1-6-4-8(10,5-6)7-2-3-11-9-7/h2-3,6,10H,4-5H2,1H3
InChIKeyPQNGUWLSKDPCBT-UHFFFAOYSA-N
XLogP1.76
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,4-Difluoro-1-(1,2-thiazol-3-yl)cyclohex-2-en-1-ol
CID 165492024
1-(1,2-Thiazol-3-yl)butan-1-ol
CID 130642506
5-Methyl-2-(1,2-thiazol-3-yl)hex-3-yn-2-ol
CID 176629056
2-(1,2-Thiazol-3-yl)propan-2-ol
CID 119097575
3-Methyl-2-(1,2-thiazol-3-yl)butan-2-ol
CID 126985702
(2,2,3,3-Tetramethylcyclopropyl)-(1,2-thiazol-3-yl)methanol
CID 126985705
2,2,3,3-Tetramethyl-1-(1,2-thiazol-3-yl)butan-1-ol
CID 126985711
3,3-Dimethyl-1-(1,2-thiazol-3-yl)butane-1,2-diol
CID 126985715
1-Cyclopropyl-2-(1,2-thiazol-3-yl)propan-2-ol
CID 126985747
3-(1,2-Thiazol-3-yl)thiolan-3-ol
CID 126985770
Cyclopropyl(1,2-thiazol-3-yl)methanol
CID 127002567
4-Methyl-1-(1,2-thiazol-3-yl)cyclohexan-1-ol
CID 127002594

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol?
The IUPAC name of 3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol (CID 130604943) is 3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol.
What is the SMILES notation for 3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol?
The canonical SMILES for 3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol is CC1CC(O)(c2ccsn2)C1.
What is the InChIKey of 3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol?
The InChIKey is PQNGUWLSKDPCBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NOS/c1-6-4-8(10,5-6)7-2-3-11-9-7/h2-3,6,10H,4-5H2,1H3.
What are the key properties of 3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol?
3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol has a molecular weight of 169.25 g/mol, XLogP of 1.76, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(1,2-thiazol-3-yl)cyclobutan-1-ol is sourced from PubChem (CID 130604943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).