6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine

C13H21N3O3S — CID 43581406

IUPAC6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCC(C)(C)Oc1nc(N2CCS(=O)(=O)CC2)ccc1N
InChIInChI=1S/C13H21N3O3S/c1-13(2,3)19-12-10(14)4-5-11(15-12)16-6-8-20(17,18)9-7-16/h4-5H,6-9,14H2,1-3H3
InChIKeySAQUFCGNQUEBHH-UHFFFAOYSA-N
MW299.40 g/mol
LogP1.08
Rot. Bonds2

About 6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine

6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (PubChem CID 43581406) has the molecular formula C13H21N3O3S and a molecular weight of 299.40 g/mol. Its IUPAC name is 6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.

Molecular Properties

Compound Name6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
PubChem CID43581406
Molecular FormulaC13H21N3O3S
Molecular Weight299.40 g/mol
Exact Mass299.13
IUPAC Name6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCC(C)(C)Oc1nc(N2CCS(=O)(=O)CC2)ccc1N
InChIInChI=1S/C13H21N3O3S/c1-13(2,3)19-12-10(14)4-5-11(15-12)16-6-8-20(17,18)9-7-16/h4-5H,6-9,14H2,1-3H3
InChIKeySAQUFCGNQUEBHH-UHFFFAOYSA-N
XLogP1.08
TPSA85.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.40
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine with MolForge

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Related Compounds

6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 43260821
6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-ethoxypyridin-3-amine
CID 43581401
6-(4-ethyl-4-methylpiperidin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 63405995
6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-propoxypyridin-3-amine
CID 43581403
6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 43260661
6-(1,1-dioxo-1,4-thiazinan-4-yl)pyridine-2,3-diamine
CID 79827353
6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 63972677
1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol
CID 106835333
6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 81451106
6-(2,3-dihydroindol-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 43260703
6-(2,4-dimethylpiperidin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 62332285
tert-butyl 4-(5-amino-6-methoxy-2-pyridinyl)piperazine-1-carboxylate;ethane
CID 145279147

Frequently Asked Questions

What is the IUPAC name of 6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The IUPAC name of 6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (CID 43581406) is 6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.
What is the SMILES notation for 6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The canonical SMILES for 6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is CC(C)(C)Oc1nc(N2CCS(=O)(=O)CC2)ccc1N.
What is the InChIKey of 6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The InChIKey is SAQUFCGNQUEBHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O3S/c1-13(2,3)19-12-10(14)4-5-11(15-12)16-6-8-20(17,18)9-7-16/h4-5H,6-9,14H2,1-3H3.
What are the key properties of 6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine has a molecular weight of 299.40 g/mol, XLogP of 1.08, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is sourced from PubChem (CID 43581406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).