3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide

C19H20N2O2S — CID 705782

IUPAC3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide
SMILESCc1ccc(Cc2cnc(NC(=O)CCc3ccc(C)o3)s2)cc1
InChIInChI=1S/C19H20N2O2S/c1-13-3-6-15(7-4-13)11-17-12-20-19(24-17)21-18(22)10-9-16-8-5-14(2)23-16/h3-8,12H,9-11H2,1-2H3,(H,20,21,22)
InChIKeyUPGFKJOUVXACSA-UHFFFAOYSA-N
MW340.45 g/mol
LogP4.52
Rot. Bonds6

About 3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide

3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide (PubChem CID 705782) has the molecular formula C19H20N2O2S and a molecular weight of 340.45 g/mol. Its IUPAC name is 3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide.

Molecular Properties

Compound Name3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide
PubChem CID705782
Molecular FormulaC19H20N2O2S
Molecular Weight340.45 g/mol
Exact Mass340.12
IUPAC Name3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide
SMILESCc1ccc(Cc2cnc(NC(=O)CCc3ccc(C)o3)s2)cc1
InChIInChI=1S/C19H20N2O2S/c1-13-3-6-15(7-4-13)11-17-12-20-19(24-17)21-18(22)10-9-16-8-5-14(2)23-16/h3-8,12H,9-11H2,1-2H3,(H,20,21,22)
InChIKeyUPGFKJOUVXACSA-UHFFFAOYSA-N
XLogP4.52
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-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-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide?
The IUPAC name of 3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide (CID 705782) is 3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide.
What is the SMILES notation for 3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide?
The canonical SMILES for 3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide is Cc1ccc(Cc2cnc(NC(=O)CCc3ccc(C)o3)s2)cc1.
What is the InChIKey of 3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide?
The InChIKey is UPGFKJOUVXACSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2S/c1-13-3-6-15(7-4-13)11-17-12-20-19(24-17)21-18(22)10-9-16-8-5-14(2)23-16/h3-8,12H,9-11H2,1-2H3,(H,20,21,22).
What are the key properties of 3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide?
3-(5-methylfuran-2-yl)-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide has a molecular weight of 340.45 g/mol, XLogP of 4.52, 6 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-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]propanamide is sourced from PubChem (CID 705782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).