1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol

C9H13NO2S — CID 126985713

IUPAC1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol
SMILESOC(c1ccsn1)C1(O)CCCC1
InChIInChI=1S/C9H13NO2S/c11-8(7-3-6-13-10-7)9(12)4-1-2-5-9/h3,6,8,11-12H,1-2,4-5H2
InChIKeyRDUGXYZKTJBFSS-UHFFFAOYSA-N
MW199.28 g/mol
LogP1.48
Rot. Bonds2

About 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol

1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol (PubChem CID 126985713) has the molecular formula C9H13NO2S and a molecular weight of 199.28 g/mol. Its IUPAC name is 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol
PubChem CID126985713
Molecular FormulaC9H13NO2S
Molecular Weight199.28 g/mol
Exact Mass199.07
IUPAC Name1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol
SMILESOC(c1ccsn1)C1(O)CCCC1
InChIInChI=1S/C9H13NO2S/c11-8(7-3-6-13-10-7)9(12)4-1-2-5-9/h3,6,8,11-12H,1-2,4-5H2
InChIKeyRDUGXYZKTJBFSS-UHFFFAOYSA-N
XLogP1.48
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.28
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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
(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
1-[Hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol
CID 126985714
3,3-Dimethyl-1-(1,2-thiazol-3-yl)butane-1,2-diol
CID 126985715
Thian-2-yl(1,2-thiazol-3-yl)methanol
CID 126985730
1-Cyclopropyl-2-(1,2-thiazol-3-yl)propan-2-ol
CID 126985747
Cyclopropyl(1,2-thiazol-3-yl)methanol
CID 127002567
2-Methoxy-2-methyl-1-(1,2-thiazol-3-yl)propan-1-ol
CID 127002572
4-Methyl-1-(1,2-thiazol-3-yl)cyclohexan-1-ol
CID 127002594
2-Methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol
CID 127004478

Frequently Asked Questions

What is the IUPAC name of 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol (CID 126985713) is 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol is OC(c1ccsn1)C1(O)CCCC1.
What is the InChIKey of 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol?
The InChIKey is RDUGXYZKTJBFSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2S/c11-8(7-3-6-13-10-7)9(12)4-1-2-5-9/h3,6,8,11-12H,1-2,4-5H2.
What are the key properties of 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol?
1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol has a molecular weight of 199.28 g/mol, XLogP of 1.48, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol is sourced from PubChem (CID 126985713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).