(5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine

C6H12N2S — CID 54319637

IUPAC(5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESC[C@@H]1SC(N)=NC[C@@H]1C
InChIInChI=1S/C6H12N2S/c1-4-3-8-6(7)9-5(4)2/h4-5H,3H2,1-2H3,(H2,7,8)/t4-,5-/m0/s1
InChIKeySQSBYAOEOUCHQW-WHFBIAKZSA-N
MW144.24 g/mol
LogP1.07
Rot. Bonds

About (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine

(5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 54319637) has the molecular formula C6H12N2S and a molecular weight of 144.24 g/mol. Its IUPAC name is (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound Name(5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID54319637
Molecular FormulaC6H12N2S
Molecular Weight144.24 g/mol
Exact Mass144.07
IUPAC Name(5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESC[C@@H]1SC(N)=NC[C@@H]1C
InChIInChI=1S/C6H12N2S/c1-4-3-8-6(7)9-5(4)2/h4-5H,3H2,1-2H3,(H2,7,8)/t4-,5-/m0/s1
InChIKeySQSBYAOEOUCHQW-WHFBIAKZSA-N
XLogP1.07
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.24
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 54319637) is (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine is C[C@@H]1SC(N)=NC[C@@H]1C.
What is the InChIKey of (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is SQSBYAOEOUCHQW-WHFBIAKZSA-N. The full InChI is InChI=1S/C6H12N2S/c1-4-3-8-6(7)9-5(4)2/h4-5H,3H2,1-2H3,(H2,7,8)/t4-,5-/m0/s1.
What are the key properties of (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine?
(5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 144.24 g/mol, XLogP of 1.07, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S,6S)-5,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 54319637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).