6-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine

C10H15N3O2S — CID 79243530

IUPAC6-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine
SMILESNc1cccc(CN2CCS(=O)(=O)CC2)n1
InChIInChI=1S/C10H15N3O2S/c11-10-3-1-2-9(12-10)8-13-4-6-16(14,15)7-5-13/h1-3H,4-8H2,(H2,11,12)
InChIKeyOSFFOJYYDMQYSB-UHFFFAOYSA-N
MW241.32 g/mol
LogP-0.11
Rot. Bonds2

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

6-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine (PubChem CID 79243530) 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)methyl]pyridin-2-amine.

Molecular Properties

Compound Name6-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine
PubChem CID79243530
Molecular FormulaC10H15N3O2S
Molecular Weight241.32 g/mol
Exact Mass241.09
IUPAC Name6-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine
SMILESNc1cccc(CN2CCS(=O)(=O)CC2)n1
InChIInChI=1S/C10H15N3O2S/c11-10-3-1-2-9(12-10)8-13-4-6-16(14,15)7-5-13/h1-3H,4-8H2,(H2,11,12)
InChIKeyOSFFOJYYDMQYSB-UHFFFAOYSA-N
XLogP-0.11
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 ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine?
The IUPAC name of 6-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine (CID 79243530) is 6-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 6-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine?
The canonical SMILES for 6-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine is Nc1cccc(CN2CCS(=O)(=O)CC2)n1.
What is the InChIKey of 6-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine?
The InChIKey is OSFFOJYYDMQYSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2S/c11-10-3-1-2-9(12-10)8-13-4-6-16(14,15)7-5-13/h1-3H,4-8H2,(H2,11,12).
What are the key properties of 6-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine?
6-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine has a molecular weight of 241.32 g/mol, XLogP of -0.11, 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)methyl]pyridin-2-amine is sourced from PubChem (CID 79243530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).