5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine

C12H20N4S — CID 82382186

IUPAC5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine
SMILESCN1CC(N)CC(c2cn3c(n2)SCCC3)C1
InChIInChI=1S/C12H20N4S/c1-15-6-9(5-10(13)7-15)11-8-16-3-2-4-17-12(16)14-11/h8-10H,2-7,13H2,1H3
InChIKeyBWTPIHBFXVYQBG-UHFFFAOYSA-N
MW252.39 g/mol
LogP1.13
Rot. Bonds1

About 5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine

5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine (PubChem CID 82382186) has the molecular formula C12H20N4S and a molecular weight of 252.39 g/mol. Its IUPAC name is 5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine.

Molecular Properties

Compound Name5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine
PubChem CID82382186
Molecular FormulaC12H20N4S
Molecular Weight252.39 g/mol
Exact Mass252.14
IUPAC Name5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine
SMILESCN1CC(N)CC(c2cn3c(n2)SCCC3)C1
InChIInChI=1S/C12H20N4S/c1-15-6-9(5-10(13)7-15)11-8-16-3-2-4-17-12(16)14-11/h8-10H,2-7,13H2,1H3
InChIKeyBWTPIHBFXVYQBG-UHFFFAOYSA-N
XLogP1.13
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.39
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine?
The IUPAC name of 5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine (CID 82382186) is 5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine.
What is the SMILES notation for 5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine?
The canonical SMILES for 5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine is CN1CC(N)CC(c2cn3c(n2)SCCC3)C1.
What is the InChIKey of 5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine?
The InChIKey is BWTPIHBFXVYQBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4S/c1-15-6-9(5-10(13)7-15)11-8-16-3-2-4-17-12(16)14-11/h8-10H,2-7,13H2,1H3.
What are the key properties of 5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine?
5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine has a molecular weight of 252.39 g/mol, XLogP of 1.13, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-2-yl)-1-methylpiperidin-3-amine is sourced from PubChem (CID 82382186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).