1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol

C10H15NOS2 — CID 65213237

IUPAC1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol
SMILESCc1csc(SCC2(O)CCCC2)n1
InChIInChI=1S/C10H15NOS2/c1-8-6-13-9(11-8)14-7-10(12)4-2-3-5-10/h6,12H,2-5,7H2,1H3
InChIKeyJHPVSWMNNKSVJZ-UHFFFAOYSA-N
MW229.37 g/mol
LogP2.85
Rot. Bonds3

About 1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol

1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol (PubChem CID 65213237) has the molecular formula C10H15NOS2 and a molecular weight of 229.37 g/mol. Its IUPAC name is 1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol
PubChem CID65213237
Molecular FormulaC10H15NOS2
Molecular Weight229.37 g/mol
Exact Mass229.06
IUPAC Name1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol
SMILESCc1csc(SCC2(O)CCCC2)n1
InChIInChI=1S/C10H15NOS2/c1-8-6-13-9(11-8)14-7-10(12)4-2-3-5-10/h6,12H,2-5,7H2,1H3
InChIKeyJHPVSWMNNKSVJZ-UHFFFAOYSA-N
XLogP2.85
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol?
The IUPAC name of 1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol (CID 65213237) is 1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol is Cc1csc(SCC2(O)CCCC2)n1.
What is the InChIKey of 1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol?
The InChIKey is JHPVSWMNNKSVJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NOS2/c1-8-6-13-9(11-8)14-7-10(12)4-2-3-5-10/h6,12H,2-5,7H2,1H3.
What are the key properties of 1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol?
1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol has a molecular weight of 229.37 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]cyclopentan-1-ol is sourced from PubChem (CID 65213237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).