3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide

C11H12N2O2S — CID 705798

IUPAC3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide
SMILESCc1ccc(CCC(=O)Nc2nccs2)o1
InChIInChI=1S/C11H12N2O2S/c1-8-2-3-9(15-8)4-5-10(14)13-11-12-6-7-16-11/h2-3,6-7H,4-5H2,1H3,(H,12,13,14)
InChIKeyVHRJMOLKPWVEGH-UHFFFAOYSA-N
MW236.30 g/mol
LogP2.62
Rot. Bonds4

About 3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide

3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide (PubChem CID 705798) has the molecular formula C11H12N2O2S and a molecular weight of 236.30 g/mol. Its IUPAC name is 3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide
PubChem CID705798
Molecular FormulaC11H12N2O2S
Molecular Weight236.30 g/mol
Exact Mass236.06
IUPAC Name3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide
SMILESCc1ccc(CCC(=O)Nc2nccs2)o1
InChIInChI=1S/C11H12N2O2S/c1-8-2-3-9(15-8)4-5-10(14)13-11-12-6-7-16-11/h2-3,6-7H,4-5H2,1H3,(H,12,13,14)
InChIKeyVHRJMOLKPWVEGH-UHFFFAOYSA-N
XLogP2.62
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)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 3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide?
The IUPAC name of 3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide (CID 705798) is 3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide is Cc1ccc(CCC(=O)Nc2nccs2)o1.
What is the InChIKey of 3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide?
The InChIKey is VHRJMOLKPWVEGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2S/c1-8-2-3-9(15-8)4-5-10(14)13-11-12-6-7-16-11/h2-3,6-7H,4-5H2,1H3,(H,12,13,14).
What are the key properties of 3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide?
3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide has a molecular weight of 236.30 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methylfuran-2-yl)-N-(1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 705798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).