2-thiomorpholin-4-ylcyclopentan-1-ol

C9H17NOS — CID 60886307

IUPAC2-thiomorpholin-4-ylcyclopentan-1-ol
SMILESOC1CCCC1N1CCSCC1
InChIInChI=1S/C9H17NOS/c11-9-3-1-2-8(9)10-4-6-12-7-5-10/h8-9,11H,1-7H2
InChIKeyHLORCBWKRMKCLK-UHFFFAOYSA-N
MW187.31 g/mol
LogP0.95
Rot. Bonds1

About 2-thiomorpholin-4-ylcyclopentan-1-ol

2-thiomorpholin-4-ylcyclopentan-1-ol (PubChem CID 60886307) has the molecular formula C9H17NOS and a molecular weight of 187.31 g/mol. Its IUPAC name is 2-thiomorpholin-4-ylcyclopentan-1-ol.

Molecular Properties

Compound Name2-thiomorpholin-4-ylcyclopentan-1-ol
PubChem CID60886307
Molecular FormulaC9H17NOS
Molecular Weight187.31 g/mol
Exact Mass187.10
IUPAC Name2-thiomorpholin-4-ylcyclopentan-1-ol
SMILESOC1CCCC1N1CCSCC1
InChIInChI=1S/C9H17NOS/c11-9-3-1-2-8(9)10-4-6-12-7-5-10/h8-9,11H,1-7H2
InChIKeyHLORCBWKRMKCLK-UHFFFAOYSA-N
XLogP0.95
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.31
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-thiomorpholin-4-ylcyclopentan-1-ol?
The IUPAC name of 2-thiomorpholin-4-ylcyclopentan-1-ol (CID 60886307) is 2-thiomorpholin-4-ylcyclopentan-1-ol.
What is the SMILES notation for 2-thiomorpholin-4-ylcyclopentan-1-ol?
The canonical SMILES for 2-thiomorpholin-4-ylcyclopentan-1-ol is OC1CCCC1N1CCSCC1.
What is the InChIKey of 2-thiomorpholin-4-ylcyclopentan-1-ol?
The InChIKey is HLORCBWKRMKCLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NOS/c11-9-3-1-2-8(9)10-4-6-12-7-5-10/h8-9,11H,1-7H2.
What are the key properties of 2-thiomorpholin-4-ylcyclopentan-1-ol?
2-thiomorpholin-4-ylcyclopentan-1-ol has a molecular weight of 187.31 g/mol, XLogP of 0.95, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiomorpholin-4-ylcyclopentan-1-ol is sourced from PubChem (CID 60886307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).