5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen

C4H10N2S — CID 156743319

IUPAC5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen
SMILESNC1=NCCCS1.[H][H]
InChIInChI=1S/C4H8N2S.H2/c5-4-6-2-1-3-7-4;/h1-3H2,(H2,5,6);1H
InChIKeyCSMDJNGLCQTOJC-UHFFFAOYSA-N
MW118.20 g/mol
LogP0.68
Rot. Bonds

About 5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen

5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen (PubChem CID 156743319) has the molecular formula C4H10N2S and a molecular weight of 118.20 g/mol. Its IUPAC name is 5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen.

Molecular Properties

Compound Name5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen
PubChem CID156743319
Molecular FormulaC4H10N2S
Molecular Weight118.20 g/mol
Exact Mass118.06
IUPAC Name5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen
SMILESNC1=NCCCS1.[H][H]
InChIInChI=1S/C4H8N2S.H2/c5-4-6-2-1-3-7-4;/h1-3H2,(H2,5,6);1H
InChIKeyCSMDJNGLCQTOJC-UHFFFAOYSA-N
XLogP0.68
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.20
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen?
The IUPAC name of 5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen (CID 156743319) is 5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen.
What is the SMILES notation for 5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen?
The canonical SMILES for 5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen is NC1=NCCCS1.[H][H].
What is the InChIKey of 5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen?
The InChIKey is CSMDJNGLCQTOJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2S.H2/c5-4-6-2-1-3-7-4;/h1-3H2,(H2,5,6);1H.
What are the key properties of 5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen?
5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen has a molecular weight of 118.20 g/mol, XLogP of 0.68, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydro-4H-1,3-thiazin-2-amine;molecular hydrogen is sourced from PubChem (CID 156743319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).