5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine

C11H15N3S — CID 107585935

IUPAC5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCc1cncc(NC2=NCC(C)CS2)c1
InChIInChI=1S/C11H15N3S/c1-8-3-10(6-12-4-8)14-11-13-5-9(2)7-15-11/h3-4,6,9H,5,7H2,1-2H3,(H,13,14)
InChIKeyHEPGXNYPTNEQND-UHFFFAOYSA-N
MW221.33 g/mol
LogP2.54
Rot. Bonds1

About 5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine

5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 107585935) has the molecular formula C11H15N3S and a molecular weight of 221.33 g/mol. Its IUPAC name is 5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound Name5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID107585935
Molecular FormulaC11H15N3S
Molecular Weight221.33 g/mol
Exact Mass221.10
IUPAC Name5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCc1cncc(NC2=NCC(C)CS2)c1
InChIInChI=1S/C11H15N3S/c1-8-3-10(6-12-4-8)14-11-13-5-9(2)7-15-11/h3-4,6,9H,5,7H2,1-2H3,(H,13,14)
InChIKeyHEPGXNYPTNEQND-UHFFFAOYSA-N
XLogP2.54
TPSA37.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of 5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 107585935) is 5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for 5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for 5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine is Cc1cncc(NC2=NCC(C)CS2)c1.
What is the InChIKey of 5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is HEPGXNYPTNEQND-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3S/c1-8-3-10(6-12-4-8)14-11-13-5-9(2)7-15-11/h3-4,6,9H,5,7H2,1-2H3,(H,13,14).
What are the key properties of 5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 221.33 g/mol, XLogP of 2.54, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(5-methyl-3-pyridinyl)-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 107585935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).