6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one

C10H18N2OS — CID 167238246

IUPAC6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one
SMILESCCC1(C)CSC2CCC(N)C(=O)N21
InChIInChI=1S/C10H18N2OS/c1-3-10(2)6-14-8-5-4-7(11)9(13)12(8)10/h7-8H,3-6,11H2,1-2H3
InChIKeyRKJCKKQIWATTPT-UHFFFAOYSA-N
MW214.33 g/mol
LogP1.18
Rot. Bonds1

About 6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one

6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one (PubChem CID 167238246) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is 6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one.

Molecular Properties

Compound Name6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one
PubChem CID167238246
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC Name6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one
SMILESCCC1(C)CSC2CCC(N)C(=O)N21
InChIInChI=1S/C10H18N2OS/c1-3-10(2)6-14-8-5-4-7(11)9(13)12(8)10/h7-8H,3-6,11H2,1-2H3
InChIKeyRKJCKKQIWATTPT-UHFFFAOYSA-N
XLogP1.18
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one 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-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one?
The IUPAC name of 6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one (CID 167238246) is 6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one.
What is the SMILES notation for 6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one?
The canonical SMILES for 6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one is CCC1(C)CSC2CCC(N)C(=O)N21.
What is the InChIKey of 6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one?
The InChIKey is RKJCKKQIWATTPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2OS/c1-3-10(2)6-14-8-5-4-7(11)9(13)12(8)10/h7-8H,3-6,11H2,1-2H3.
What are the key properties of 6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one?
6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one has a molecular weight of 214.33 g/mol, XLogP of 1.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-ethyl-3-methyl-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one is sourced from PubChem (CID 167238246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).