[2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine

C11H17N3O2S — CID 102882640

IUPAC[2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine
SMILESCC1CS(=O)(=O)CCN1c1ncccc1CN
InChIInChI=1S/C11H17N3O2S/c1-9-8-17(15,16)6-5-14(9)11-10(7-12)3-2-4-13-11/h2-4,9H,5-8,12H2,1H3
InChIKeyUSPFBWXIKILERT-UHFFFAOYSA-N
MW255.34 g/mol
LogP0.16
Rot. Bonds2

About [2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine

[2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine (PubChem CID 102882640) has the molecular formula C11H17N3O2S and a molecular weight of 255.34 g/mol. Its IUPAC name is [2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine
PubChem CID102882640
Molecular FormulaC11H17N3O2S
Molecular Weight255.34 g/mol
Exact Mass255.10
IUPAC Name[2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine
SMILESCC1CS(=O)(=O)CCN1c1ncccc1CN
InChIInChI=1S/C11H17N3O2S/c1-9-8-17(15,16)6-5-14(9)11-10(7-12)3-2-4-13-11/h2-4,9H,5-8,12H2,1H3
InChIKeyUSPFBWXIKILERT-UHFFFAOYSA-N
XLogP0.16
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N'-hydroxy-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyridine-3-carboximidamide
CID 102883716
[2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidin-5-yl]methanamine
CID 102884804
[4-bromo-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)phenyl]methanamine
CID 102882649
3-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-1H-pyrazin-2-one
CID 102888057
2-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]ethanamine
CID 114057385
[2-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]methanamine
CID 63605164
[1-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)isoquinolin-3-yl]methanol
CID 102885836
2-[5-methyl-6-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]ethanamine
CID 102887231
4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine
CID 102887639
[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanol
CID 61257905
[2-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methanamine
CID 61223462
3,5-difluoro-6-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyridin-2-amine
CID 114074771

Frequently Asked Questions

What is the IUPAC name of [2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine?
The IUPAC name of [2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine (CID 102882640) is [2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine.
What is the SMILES notation for [2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine?
The canonical SMILES for [2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine is CC1CS(=O)(=O)CCN1c1ncccc1CN.
What is the InChIKey of [2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine?
The InChIKey is USPFBWXIKILERT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2S/c1-9-8-17(15,16)6-5-14(9)11-10(7-12)3-2-4-13-11/h2-4,9H,5-8,12H2,1H3.
What are the key properties of [2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine?
[2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine has a molecular weight of 255.34 g/mol, XLogP of 0.16, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine is sourced from PubChem (CID 102882640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).