4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine

C15H24N2S2 — CID 106351802

IUPAC4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCC(Cc1cccs1)NC1=NC(C(C)(C)C)CCS1
InChIInChI=1S/C15H24N2S2/c1-11(10-12-6-5-8-18-12)16-14-17-13(7-9-19-14)15(2,3)4/h5-6,8,11,13H,7,9-10H2,1-4H3,(H,16,17)
InChIKeyFBHCAWOGIHTPBR-UHFFFAOYSA-N
MW296.50 g/mol
LogP4.18
Rot. Bonds3

About 4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine

4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 106351802) has the molecular formula C15H24N2S2 and a molecular weight of 296.50 g/mol. Its IUPAC name is 4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound Name4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID106351802
Molecular FormulaC15H24N2S2
Molecular Weight296.50 g/mol
Exact Mass296.14
IUPAC Name4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCC(Cc1cccs1)NC1=NC(C(C)(C)C)CCS1
InChIInChI=1S/C15H24N2S2/c1-11(10-12-6-5-8-18-12)16-14-17-13(7-9-19-14)15(2,3)4/h5-6,8,11,13H,7,9-10H2,1-4H3,(H,16,17)
InChIKeyFBHCAWOGIHTPBR-UHFFFAOYSA-N
XLogP4.18
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.50
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of 4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 106351802) is 4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for 4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for 4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine is CC(Cc1cccs1)NC1=NC(C(C)(C)C)CCS1.
What is the InChIKey of 4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is FBHCAWOGIHTPBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2S2/c1-11(10-12-6-5-8-18-12)16-14-17-13(7-9-19-14)15(2,3)4/h5-6,8,11,13H,7,9-10H2,1-4H3,(H,16,17).
What are the key properties of 4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 296.50 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-(1-thiophen-2-ylpropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 106351802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).