2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide

C11H19N3O2S — CID 55080444

IUPAC2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide
SMILESCCc1nc(NC(=O)C(N)CCOC)sc1C
InChIInChI=1S/C11H19N3O2S/c1-4-9-7(2)17-11(13-9)14-10(15)8(12)5-6-16-3/h8H,4-6,12H2,1-3H3,(H,13,14,15)
InChIKeyNNXQDPDMEFQZCW-UHFFFAOYSA-N
MW257.36 g/mol
LogP1.32
Rot. Bonds6

About 2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide

2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide (PubChem CID 55080444) has the molecular formula C11H19N3O2S and a molecular weight of 257.36 g/mol. Its IUPAC name is 2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide.

Molecular Properties

Compound Name2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide
PubChem CID55080444
Molecular FormulaC11H19N3O2S
Molecular Weight257.36 g/mol
Exact Mass257.12
IUPAC Name2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide
SMILESCCc1nc(NC(=O)C(N)CCOC)sc1C
InChIInChI=1S/C11H19N3O2S/c1-4-9-7(2)17-11(13-9)14-10(15)8(12)5-6-16-3/h8H,4-6,12H2,1-3H3,(H,13,14,15)
InChIKeyNNXQDPDMEFQZCW-UHFFFAOYSA-N
XLogP1.32
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide 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-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide?
The IUPAC name of 2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide (CID 55080444) is 2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide.
What is the SMILES notation for 2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide?
The canonical SMILES for 2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide is CCc1nc(NC(=O)C(N)CCOC)sc1C.
What is the InChIKey of 2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide?
The InChIKey is NNXQDPDMEFQZCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2S/c1-4-9-7(2)17-11(13-9)14-10(15)8(12)5-6-16-3/h8H,4-6,12H2,1-3H3,(H,13,14,15).
What are the key properties of 2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide?
2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide has a molecular weight of 257.36 g/mol, XLogP of 1.32, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methoxybutanamide is sourced from PubChem (CID 55080444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).