[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine

C10H15N3O2S — CID 62286180

IUPAC[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine
SMILESNCc1cccc(N2CCS(=O)(=O)CC2)n1
InChIInChI=1S/C10H15N3O2S/c11-8-9-2-1-3-10(12-9)13-4-6-16(14,15)7-5-13/h1-3H,4-8,11H2
InChIKeyUDSMEHXPYRHBJV-UHFFFAOYSA-N
MW241.32 g/mol
LogP-0.22
Rot. Bonds2

About [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine

[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine (PubChem CID 62286180) has the molecular formula C10H15N3O2S and a molecular weight of 241.32 g/mol. Its IUPAC name is [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine
PubChem CID62286180
Molecular FormulaC10H15N3O2S
Molecular Weight241.32 g/mol
Exact Mass241.09
IUPAC Name[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine
SMILESNCc1cccc(N2CCS(=O)(=O)CC2)n1
InChIInChI=1S/C10H15N3O2S/c11-8-9-2-1-3-10(12-9)13-4-6-16(14,15)7-5-13/h1-3H,4-8,11H2
InChIKeyUDSMEHXPYRHBJV-UHFFFAOYSA-N
XLogP-0.22
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 5-0.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine?
The IUPAC name of [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine (CID 62286180) is [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine.
What is the SMILES notation for [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine?
The canonical SMILES for [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine is NCc1cccc(N2CCS(=O)(=O)CC2)n1.
What is the InChIKey of [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine?
The InChIKey is UDSMEHXPYRHBJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2S/c11-8-9-2-1-3-10(12-9)13-4-6-16(14,15)7-5-13/h1-3H,4-8,11H2.
What are the key properties of [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine?
[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine has a molecular weight of 241.32 g/mol, XLogP of -0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]methanamine is sourced from PubChem (CID 62286180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).