6-methyl-4-propan-2-yl-1,3-thiazin-6-amine

C8H14N2S — CID 129200510

IUPAC6-methyl-4-propan-2-yl-1,3-thiazin-6-amine
SMILESCC(C)C1=CC(C)(N)SC=N1
InChIInChI=1S/C8H14N2S/c1-6(2)7-4-8(3,9)11-5-10-7/h4-6H,9H2,1-3H3
InChIKeyBUWXLUYSDBVUFO-UHFFFAOYSA-N
MW170.28 g/mol
LogP1.98
Rot. Bonds1

About 6-methyl-4-propan-2-yl-1,3-thiazin-6-amine

6-methyl-4-propan-2-yl-1,3-thiazin-6-amine (PubChem CID 129200510) has the molecular formula C8H14N2S and a molecular weight of 170.28 g/mol. Its IUPAC name is 6-methyl-4-propan-2-yl-1,3-thiazin-6-amine.

Molecular Properties

Compound Name6-methyl-4-propan-2-yl-1,3-thiazin-6-amine
PubChem CID129200510
Molecular FormulaC8H14N2S
Molecular Weight170.28 g/mol
Exact Mass170.09
IUPAC Name6-methyl-4-propan-2-yl-1,3-thiazin-6-amine
SMILESCC(C)C1=CC(C)(N)SC=N1
InChIInChI=1S/C8H14N2S/c1-6(2)7-4-8(3,9)11-5-10-7/h4-6H,9H2,1-3H3
InChIKeyBUWXLUYSDBVUFO-UHFFFAOYSA-N
XLogP1.98
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.28
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-propan-2-yl-1,3-thiazin-6-amine?
The IUPAC name of 6-methyl-4-propan-2-yl-1,3-thiazin-6-amine (CID 129200510) is 6-methyl-4-propan-2-yl-1,3-thiazin-6-amine.
What is the SMILES notation for 6-methyl-4-propan-2-yl-1,3-thiazin-6-amine?
The canonical SMILES for 6-methyl-4-propan-2-yl-1,3-thiazin-6-amine is CC(C)C1=CC(C)(N)SC=N1.
What is the InChIKey of 6-methyl-4-propan-2-yl-1,3-thiazin-6-amine?
The InChIKey is BUWXLUYSDBVUFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2S/c1-6(2)7-4-8(3,9)11-5-10-7/h4-6H,9H2,1-3H3.
What are the key properties of 6-methyl-4-propan-2-yl-1,3-thiazin-6-amine?
6-methyl-4-propan-2-yl-1,3-thiazin-6-amine has a molecular weight of 170.28 g/mol, XLogP of 1.98, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-propan-2-yl-1,3-thiazin-6-amine is sourced from PubChem (CID 129200510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).