1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine

C11H22N2OS — CID 64677709

IUPAC1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine
SMILESNC1(CCN2CCS(=O)CC2)CCCC1
InChIInChI=1S/C11H22N2OS/c12-11(3-1-2-4-11)5-6-13-7-9-15(14)10-8-13/h1-10,12H2
InChIKeyXDVAVIHBFSQJAS-UHFFFAOYSA-N
MW230.38 g/mol
LogP0.71
Rot. Bonds3

About 1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine

1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine (PubChem CID 64677709) has the molecular formula C11H22N2OS and a molecular weight of 230.38 g/mol. Its IUPAC name is 1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine
PubChem CID64677709
Molecular FormulaC11H22N2OS
Molecular Weight230.38 g/mol
Exact Mass230.15
IUPAC Name1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine
SMILESNC1(CCN2CCS(=O)CC2)CCCC1
InChIInChI=1S/C11H22N2OS/c12-11(3-1-2-4-11)5-6-13-7-9-15(14)10-8-13/h1-10,12H2
InChIKeyXDVAVIHBFSQJAS-UHFFFAOYSA-N
XLogP0.71
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-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 1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine?
The IUPAC name of 1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine (CID 64677709) is 1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine.
What is the SMILES notation for 1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine?
The canonical SMILES for 1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine is NC1(CCN2CCS(=O)CC2)CCCC1.
What is the InChIKey of 1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine?
The InChIKey is XDVAVIHBFSQJAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2OS/c12-11(3-1-2-4-11)5-6-13-7-9-15(14)10-8-13/h1-10,12H2.
What are the key properties of 1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine?
1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine has a molecular weight of 230.38 g/mol, XLogP of 0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 64677709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).