4-methyl-6-phenyl-6H-1,3-thiazin-2-amine

C11H12N2S — CID 45096900

IUPAC4-methyl-6-phenyl-6H-1,3-thiazin-2-amine
SMILESCC1=CC(c2ccccc2)SC(N)=N1
InChIInChI=1S/C11H12N2S/c1-8-7-10(14-11(12)13-8)9-5-3-2-4-6-9/h2-7,10H,1H3,(H2,12,13)
InChIKeyGWHZAHCAVPMCRN-UHFFFAOYSA-N
MW204.30 g/mol
LogP2.69
Rot. Bonds1

About 4-methyl-6-phenyl-6H-1,3-thiazin-2-amine

4-methyl-6-phenyl-6H-1,3-thiazin-2-amine (PubChem CID 45096900) has the molecular formula C11H12N2S and a molecular weight of 204.30 g/mol. Its IUPAC name is 4-methyl-6-phenyl-6H-1,3-thiazin-2-amine.

Molecular Properties

Compound Name4-methyl-6-phenyl-6H-1,3-thiazin-2-amine
PubChem CID45096900
Molecular FormulaC11H12N2S
Molecular Weight204.30 g/mol
Exact Mass204.07
IUPAC Name4-methyl-6-phenyl-6H-1,3-thiazin-2-amine
SMILESCC1=CC(c2ccccc2)SC(N)=N1
InChIInChI=1S/C11H12N2S/c1-8-7-10(14-11(12)13-8)9-5-3-2-4-6-9/h2-7,10H,1H3,(H2,12,13)
InChIKeyGWHZAHCAVPMCRN-UHFFFAOYSA-N
XLogP2.69
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.30
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-phenyl-6H-1,3-thiazin-2-amine?
The IUPAC name of 4-methyl-6-phenyl-6H-1,3-thiazin-2-amine (CID 45096900) is 4-methyl-6-phenyl-6H-1,3-thiazin-2-amine.
What is the SMILES notation for 4-methyl-6-phenyl-6H-1,3-thiazin-2-amine?
The canonical SMILES for 4-methyl-6-phenyl-6H-1,3-thiazin-2-amine is CC1=CC(c2ccccc2)SC(N)=N1.
What is the InChIKey of 4-methyl-6-phenyl-6H-1,3-thiazin-2-amine?
The InChIKey is GWHZAHCAVPMCRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2S/c1-8-7-10(14-11(12)13-8)9-5-3-2-4-6-9/h2-7,10H,1H3,(H2,12,13).
What are the key properties of 4-methyl-6-phenyl-6H-1,3-thiazin-2-amine?
4-methyl-6-phenyl-6H-1,3-thiazin-2-amine has a molecular weight of 204.30 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-phenyl-6H-1,3-thiazin-2-amine is sourced from PubChem (CID 45096900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).