cyclopenta[d]thiazine

C7H5NS — CID 91533308

IUPACcyclopenta[d]thiazine
SMILESc1cc2cnscc-2c1
InChIInChI=1S/C7H5NS/c1-2-6-4-8-9-5-7(6)3-1/h1-5H
InChIKeyFJROUDCKSVIHLO-UHFFFAOYSA-N
MW135.19 g/mol
LogP2.25
Rot. Bonds

About cyclopenta[d]thiazine

cyclopenta[d]thiazine (PubChem CID 91533308) has the molecular formula C7H5NS and a molecular weight of 135.19 g/mol. Its IUPAC name is cyclopenta[d]thiazine.

Molecular Properties

Compound Namecyclopenta[d]thiazine
PubChem CID91533308
Molecular FormulaC7H5NS
Molecular Weight135.19 g/mol
Exact Mass135.01
IUPAC Namecyclopenta[d]thiazine
SMILESc1cc2cnscc-2c1
InChIInChI=1S/C7H5NS/c1-2-6-4-8-9-5-7(6)3-1/h1-5H
InChIKeyFJROUDCKSVIHLO-UHFFFAOYSA-N
XLogP2.25
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.19
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopenta[d]thiazine?
The IUPAC name of cyclopenta[d]thiazine (CID 91533308) is cyclopenta[d]thiazine.
What is the SMILES notation for cyclopenta[d]thiazine?
The canonical SMILES for cyclopenta[d]thiazine is c1cc2cnscc-2c1.
What is the InChIKey of cyclopenta[d]thiazine?
The InChIKey is FJROUDCKSVIHLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5NS/c1-2-6-4-8-9-5-7(6)3-1/h1-5H.
What are the key properties of cyclopenta[d]thiazine?
cyclopenta[d]thiazine has a molecular weight of 135.19 g/mol, XLogP of 2.25, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta[d]thiazine is sourced from PubChem (CID 91533308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).