5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine

C16H30N2S — CID 103968036

IUPAC5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine
SMILESCC1(C)CN=C(NC2CC(C)(C)CC(C)(C)C2)SC1
InChIInChI=1S/C16H30N2S/c1-14(2)7-12(8-15(3,4)9-14)18-13-17-10-16(5,6)11-19-13/h12H,7-11H2,1-6H3,(H,17,18)
InChIKeyFGQABKJDGNLWMO-UHFFFAOYSA-N
MW282.50 g/mol
LogP4.31
Rot. Bonds1

About 5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine

5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine (PubChem CID 103968036) has the molecular formula C16H30N2S and a molecular weight of 282.50 g/mol. Its IUPAC name is 5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine.

Molecular Properties

Compound Name5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine
PubChem CID103968036
Molecular FormulaC16H30N2S
Molecular Weight282.50 g/mol
Exact Mass282.21
IUPAC Name5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine
SMILESCC1(C)CN=C(NC2CC(C)(C)CC(C)(C)C2)SC1
InChIInChI=1S/C16H30N2S/c1-14(2)7-12(8-15(3,4)9-14)18-13-17-10-16(5,6)11-19-13/h12H,7-11H2,1-6H3,(H,17,18)
InChIKeyFGQABKJDGNLWMO-UHFFFAOYSA-N
XLogP4.31
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.50
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine?
The IUPAC name of 5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine (CID 103968036) is 5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine.
What is the SMILES notation for 5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine?
The canonical SMILES for 5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine is CC1(C)CN=C(NC2CC(C)(C)CC(C)(C)C2)SC1.
What is the InChIKey of 5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine?
The InChIKey is FGQABKJDGNLWMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2S/c1-14(2)7-12(8-15(3,4)9-14)18-13-17-10-16(5,6)11-19-13/h12H,7-11H2,1-6H3,(H,17,18).
What are the key properties of 5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine?
5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine has a molecular weight of 282.50 g/mol, XLogP of 4.31, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-N-(3,3,5,5-tetramethylcyclohexyl)-4,6-dihydro-1,3-thiazin-2-amine is sourced from PubChem (CID 103968036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).