N-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide

C17H15N3O3S2 — CID 1120959

IUPACN-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1nc(-c2cccs2)c(NC(C)=O)s1
InChIInChI=1S/C17H15N3O3S2/c1-10(21)18-16-14(13-8-5-9-24-13)19-17(25-16)20-15(22)11-6-3-4-7-12(11)23-2/h3-9H,1-2H3,(H,18,21)(H,19,20,22)
InChIKeyRCKMEVFXBIWMSL-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.09
Rot. Bonds5

About N-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide

N-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide (PubChem CID 1120959) has the molecular formula C17H15N3O3S2 and a molecular weight of 373.46 g/mol. Its IUPAC name is N-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide.

Molecular Properties

Compound NameN-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide
PubChem CID1120959
Molecular FormulaC17H15N3O3S2
Molecular Weight373.46 g/mol
Exact Mass373.06
IUPAC NameN-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1nc(-c2cccs2)c(NC(C)=O)s1
InChIInChI=1S/C17H15N3O3S2/c1-10(21)18-16-14(13-8-5-9-24-13)19-17(25-16)20-15(22)11-6-3-4-7-12(11)23-2/h3-9H,1-2H3,(H,18,21)(H,19,20,22)
InChIKeyRCKMEVFXBIWMSL-UHFFFAOYSA-N
XLogP4.09
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide 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 N-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide?
The IUPAC name of N-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide (CID 1120959) is N-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide.
What is the SMILES notation for N-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide?
The canonical SMILES for N-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide is COc1ccccc1C(=O)Nc1nc(-c2cccs2)c(NC(C)=O)s1.
What is the InChIKey of N-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide?
The InChIKey is RCKMEVFXBIWMSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O3S2/c1-10(21)18-16-14(13-8-5-9-24-13)19-17(25-16)20-15(22)11-6-3-4-7-12(11)23-2/h3-9H,1-2H3,(H,18,21)(H,19,20,22).
What are the key properties of N-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide?
N-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide has a molecular weight of 373.46 g/mol, XLogP of 4.09, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-4-thiophen-2-yl-1,3-thiazol-2-yl)-2-methoxybenzamide is sourced from PubChem (CID 1120959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).