2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride

C10H21ClN2O3S — CID 119337411

IUPAC2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride
SMILESCC(C)(N)C(=O)N1CCS(=O)(=O)C(C)(C)C1.Cl
InChIInChI=1S/C10H20N2O3S.ClH/c1-9(2)7-12(5-6-16(9,14)15)8(13)10(3,4)11;/h5-7,11H2,1-4H3;1H
InChIKeyDPALPAGUPHXCHL-UHFFFAOYSA-N
MW284.81 g/mol
LogP0.18
Rot. Bonds1

About 2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride

2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride (PubChem CID 119337411) has the molecular formula C10H21ClN2O3S and a molecular weight of 284.81 g/mol. Its IUPAC name is 2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride.

Molecular Properties

Compound Name2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride
PubChem CID119337411
Molecular FormulaC10H21ClN2O3S
Molecular Weight284.81 g/mol
Exact Mass284.10
IUPAC Name2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride
SMILESCC(C)(N)C(=O)N1CCS(=O)(=O)C(C)(C)C1.Cl
InChIInChI=1S/C10H20N2O3S.ClH/c1-9(2)7-12(5-6-16(9,14)15)8(13)10(3,4)11;/h5-7,11H2,1-4H3;1H
InChIKeyDPALPAGUPHXCHL-UHFFFAOYSA-N
XLogP0.18
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.81
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride?
The IUPAC name of 2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride (CID 119337411) is 2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride.
What is the SMILES notation for 2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride?
The canonical SMILES for 2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride is CC(C)(N)C(=O)N1CCS(=O)(=O)C(C)(C)C1.Cl.
What is the InChIKey of 2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride?
The InChIKey is DPALPAGUPHXCHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3S.ClH/c1-9(2)7-12(5-6-16(9,14)15)8(13)10(3,4)11;/h5-7,11H2,1-4H3;1H.
What are the key properties of 2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride?
2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride has a molecular weight of 284.81 g/mol, XLogP of 0.18, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2,2-dimethyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpropan-1-one;hydrochloride is sourced from PubChem (CID 119337411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).