ethane;2-methylidene-1,3-thiazine

C7H11NS — CID 91381048

IUPACethane;2-methylidene-1,3-thiazine
SMILESC=C1N=CC=CS1.CC
InChIInChI=1S/C5H5NS.C2H6/c1-5-6-3-2-4-7-5;1-2/h2-4H,1H2;1-2H3
InChIKeySCTIISFHZFUBGQ-UHFFFAOYSA-N
MW141.24 g/mol
LogP2.82
Rot. Bonds

About ethane;2-methylidene-1,3-thiazine

ethane;2-methylidene-1,3-thiazine (PubChem CID 91381048) has the molecular formula C7H11NS and a molecular weight of 141.24 g/mol. Its IUPAC name is ethane;2-methylidene-1,3-thiazine.

Molecular Properties

Compound Nameethane;2-methylidene-1,3-thiazine
PubChem CID91381048
Molecular FormulaC7H11NS
Molecular Weight141.24 g/mol
Exact Mass141.06
IUPAC Nameethane;2-methylidene-1,3-thiazine
SMILESC=C1N=CC=CS1.CC
InChIInChI=1S/C5H5NS.C2H6/c1-5-6-3-2-4-7-5;1-2/h2-4H,1H2;1-2H3
InChIKeySCTIISFHZFUBGQ-UHFFFAOYSA-N
XLogP2.82
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.24
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;2-methylidene-1,3-thiazine?
The IUPAC name of ethane;2-methylidene-1,3-thiazine (CID 91381048) is ethane;2-methylidene-1,3-thiazine.
What is the SMILES notation for ethane;2-methylidene-1,3-thiazine?
The canonical SMILES for ethane;2-methylidene-1,3-thiazine is C=C1N=CC=CS1.CC.
What is the InChIKey of ethane;2-methylidene-1,3-thiazine?
The InChIKey is SCTIISFHZFUBGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5NS.C2H6/c1-5-6-3-2-4-7-5;1-2/h2-4H,1H2;1-2H3.
What are the key properties of ethane;2-methylidene-1,3-thiazine?
ethane;2-methylidene-1,3-thiazine has a molecular weight of 141.24 g/mol, XLogP of 2.82, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methylidene-1,3-thiazine is sourced from PubChem (CID 91381048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).