2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide

C11H13N3O2S — CID 55119881

IUPAC2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide
SMILESNc1nc(CC(=O)NCCc2ccco2)cs1
InChIInChI=1S/C11H13N3O2S/c12-11-14-8(7-17-11)6-10(15)13-4-3-9-2-1-5-16-9/h1-2,5,7H,3-4,6H2,(H2,12,14)(H,13,15)
InChIKeyZHUNCMQOJQVMKJ-UHFFFAOYSA-N
MW251.31 g/mol
LogP1.22
Rot. Bonds5

About 2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide

2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide (PubChem CID 55119881) has the molecular formula C11H13N3O2S and a molecular weight of 251.31 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide
PubChem CID55119881
Molecular FormulaC11H13N3O2S
Molecular Weight251.31 g/mol
Exact Mass251.07
IUPAC Name2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide
SMILESNc1nc(CC(=O)NCCc2ccco2)cs1
InChIInChI=1S/C11H13N3O2S/c12-11-14-8(7-17-11)6-10(15)13-4-3-9-2-1-5-16-9/h1-2,5,7H,3-4,6H2,(H2,12,14)(H,13,15)
InChIKeyZHUNCMQOJQVMKJ-UHFFFAOYSA-N
XLogP1.22
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.31
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide?
The IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide (CID 55119881) is 2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide is Nc1nc(CC(=O)NCCc2ccco2)cs1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide?
The InChIKey is ZHUNCMQOJQVMKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2S/c12-11-14-8(7-17-11)6-10(15)13-4-3-9-2-1-5-16-9/h1-2,5,7H,3-4,6H2,(H2,12,14)(H,13,15).
What are the key properties of 2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide?
2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide has a molecular weight of 251.31 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-4-yl)-N-[2-(furan-2-yl)ethyl]acetamide is sourced from PubChem (CID 55119881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).