2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide

C8H15N3OS — CID 43545740

IUPAC2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide
SMILESCCC1CSC(NC(C)C(N)=O)=N1
InChIInChI=1S/C8H15N3OS/c1-3-6-4-13-8(11-6)10-5(2)7(9)12/h5-6H,3-4H2,1-2H3,(H2,9,12)(H,10,11)
InChIKeyUJIIWBAEPQHVTB-UHFFFAOYSA-N
MW201.29 g/mol
LogP0.33
Rot. Bonds3

About 2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide

2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide (PubChem CID 43545740) has the molecular formula C8H15N3OS and a molecular weight of 201.29 g/mol. Its IUPAC name is 2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide.

Molecular Properties

Compound Name2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide
PubChem CID43545740
Molecular FormulaC8H15N3OS
Molecular Weight201.29 g/mol
Exact Mass201.09
IUPAC Name2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide
SMILESCCC1CSC(NC(C)C(N)=O)=N1
InChIInChI=1S/C8H15N3OS/c1-3-6-4-13-8(11-6)10-5(2)7(9)12/h5-6H,3-4H2,1-2H3,(H2,9,12)(H,10,11)
InChIKeyUJIIWBAEPQHVTB-UHFFFAOYSA-N
XLogP0.33
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.29
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide 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 2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide?
The IUPAC name of 2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide (CID 43545740) is 2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide.
What is the SMILES notation for 2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide?
The canonical SMILES for 2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide is CCC1CSC(NC(C)C(N)=O)=N1.
What is the InChIKey of 2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide?
The InChIKey is UJIIWBAEPQHVTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3OS/c1-3-6-4-13-8(11-6)10-5(2)7(9)12/h5-6H,3-4H2,1-2H3,(H2,9,12)(H,10,11).
What are the key properties of 2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide?
2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide has a molecular weight of 201.29 g/mol, XLogP of 0.33, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethyl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide is sourced from PubChem (CID 43545740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).