N-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine

C11H20N2OS — CID 83028271

IUPACN-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCC1(C)CC(NC2=NCCCS2)CCO1
InChIInChI=1S/C11H20N2OS/c1-11(2)8-9(4-6-14-11)13-10-12-5-3-7-15-10/h9H,3-8H2,1-2H3,(H,12,13)
InChIKeySRALIXPIHOGJFA-UHFFFAOYSA-N
MW228.36 g/mol
LogP2.03
Rot. Bonds1

About N-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine

N-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 83028271) has the molecular formula C11H20N2OS and a molecular weight of 228.36 g/mol. Its IUPAC name is N-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound NameN-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID83028271
Molecular FormulaC11H20N2OS
Molecular Weight228.36 g/mol
Exact Mass228.13
IUPAC NameN-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCC1(C)CC(NC2=NCCCS2)CCO1
InChIInChI=1S/C11H20N2OS/c1-11(2)8-9(4-6-14-11)13-10-12-5-3-7-15-10/h9H,3-8H2,1-2H3,(H,12,13)
InChIKeySRALIXPIHOGJFA-UHFFFAOYSA-N
XLogP2.03
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of N-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 83028271) is N-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for N-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for N-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine is CC1(C)CC(NC2=NCCCS2)CCO1.
What is the InChIKey of N-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is SRALIXPIHOGJFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2OS/c1-11(2)8-9(4-6-14-11)13-10-12-5-3-7-15-10/h9H,3-8H2,1-2H3,(H,12,13).
What are the key properties of N-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
N-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 228.36 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyloxan-4-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 83028271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).