2-cyclohexyl-1,2-thiazolidine 1-oxide

C9H17NOS — CID 14761290

IUPAC2-cyclohexyl-1,2-thiazolidine 1-oxide
SMILESO=S1CCCN1C1CCCCC1
InChIInChI=1S/C9H17NOS/c11-12-8-4-7-10(12)9-5-2-1-3-6-9/h9H,1-8H2
InChIKeyLOVSNLHSTFKDPG-UHFFFAOYSA-N
MW187.31 g/mol
LogP1.69
Rot. Bonds1

About 2-cyclohexyl-1,2-thiazolidine 1-oxide

2-cyclohexyl-1,2-thiazolidine 1-oxide (PubChem CID 14761290) has the molecular formula C9H17NOS and a molecular weight of 187.31 g/mol. Its IUPAC name is 2-cyclohexyl-1,2-thiazolidine 1-oxide.

Molecular Properties

Compound Name2-cyclohexyl-1,2-thiazolidine 1-oxide
PubChem CID14761290
Molecular FormulaC9H17NOS
Molecular Weight187.31 g/mol
Exact Mass187.10
IUPAC Name2-cyclohexyl-1,2-thiazolidine 1-oxide
SMILESO=S1CCCN1C1CCCCC1
InChIInChI=1S/C9H17NOS/c11-12-8-4-7-10(12)9-5-2-1-3-6-9/h9H,1-8H2
InChIKeyLOVSNLHSTFKDPG-UHFFFAOYSA-N
XLogP1.69
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.31
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1,2-thiazolidine 1-oxide?
The IUPAC name of 2-cyclohexyl-1,2-thiazolidine 1-oxide (CID 14761290) is 2-cyclohexyl-1,2-thiazolidine 1-oxide.
What is the SMILES notation for 2-cyclohexyl-1,2-thiazolidine 1-oxide?
The canonical SMILES for 2-cyclohexyl-1,2-thiazolidine 1-oxide is O=S1CCCN1C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-1,2-thiazolidine 1-oxide?
The InChIKey is LOVSNLHSTFKDPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NOS/c11-12-8-4-7-10(12)9-5-2-1-3-6-9/h9H,1-8H2.
What are the key properties of 2-cyclohexyl-1,2-thiazolidine 1-oxide?
2-cyclohexyl-1,2-thiazolidine 1-oxide has a molecular weight of 187.31 g/mol, XLogP of 1.69, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1,2-thiazolidine 1-oxide is sourced from PubChem (CID 14761290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).