2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol

C9H13NO2S — CID 106923607

IUPAC2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol
SMILESCc1coc(SC2CCCC2O)n1
InChIInChI=1S/C9H13NO2S/c1-6-5-12-9(10-6)13-8-4-2-3-7(8)11/h5,7-8,11H,2-4H2,1H3
InChIKeyMYFDNCLIHZTYFD-UHFFFAOYSA-N
MW199.27 g/mol
LogP1.99
Rot. Bonds2

About 2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol

2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol (PubChem CID 106923607) has the molecular formula C9H13NO2S and a molecular weight of 199.27 g/mol. Its IUPAC name is 2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol
PubChem CID106923607
Molecular FormulaC9H13NO2S
Molecular Weight199.27 g/mol
Exact Mass199.07
IUPAC Name2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol
SMILESCc1coc(SC2CCCC2O)n1
InChIInChI=1S/C9H13NO2S/c1-6-5-12-9(10-6)13-8-4-2-3-7(8)11/h5,7-8,11H,2-4H2,1H3
InChIKeyMYFDNCLIHZTYFD-UHFFFAOYSA-N
XLogP1.99
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.27
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]-N-propylcyclopentan-1-amine
CID 106927686
N-ethyl-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclohexan-1-amine
CID 106927564
2-(cyclobutylmethylsulfanyl)-4-methyl-1,3-oxazole
CID 131203577
trans-(1R,2R)-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]cyclohexan-1-ol
CID 102732798
2-(azepan-4-ylsulfanyl)-4-methyl-1,3-oxazole
CID 130490292
trans-(1S,2S)-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentan-1-ol
CID 102735669
1-amino-3-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclohexane-1-carboxamide
CID 106925119
trans-(1R,2R)-2-(2-methylfuran-3-yl)sulfanylcyclopentan-1-ol
CID 107780914
N-methyl-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]-4-propylcyclohexan-1-amine
CID 106927660
2-[[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]cyclohexan-1-ol
CID 110883458
2-[(2-amino-4-methyl-1,3-thiazol-5-yl)sulfanyl]cyclopentan-1-ol
CID 60886467
2-(4-amino-6-methylpyrimidin-2-yl)sulfanylcycloheptan-1-ol
CID 113288637

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol?
The IUPAC name of 2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol (CID 106923607) is 2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol?
The canonical SMILES for 2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol is Cc1coc(SC2CCCC2O)n1.
What is the InChIKey of 2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol?
The InChIKey is MYFDNCLIHZTYFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2S/c1-6-5-12-9(10-6)13-8-4-2-3-7(8)11/h5,7-8,11H,2-4H2,1H3.
What are the key properties of 2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol?
2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol has a molecular weight of 199.27 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]cyclopentan-1-ol is sourced from PubChem (CID 106923607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).