2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide

C19H16N4O3S — CID 90602796

About 2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide

2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide (PubChem CID 90602796) has the molecular formula C19H16N4O3S and a molecular weight of 380.43 g/mol. Its IUPAC name is 2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide.

Molecular Properties

• Compound Name: 2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide
• PubChem CID: 90602796
• Molecular Formula: C19H16N4O3S
• Molecular Weight: 380.43 g/mol
• Exact Mass: 380.09
• IUPAC Name: 2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide
• SMILES: CCOc1ccc2ccccc2c1C(=O)Nc1nnc(-c2csc(C)n2)o1
• InChI: InChI=1S/C19H16N4O3S/c1-3-25-15-9-8-12-6-4-5-7-13(12)16(15)17(24)21-19-23-22-18(26-19)14-10-27-11(2)20-14/h4-10H,3H2,1-2H3,(H,21,23,24)
• InChIKey: ZDWTZPWBNCPNBC-UHFFFAOYSA-N
• XLogP: 4.31
• TPSA: 90.14 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	380.43
LogP ≤ 5	4.31
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide?

The IUPAC name of 2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide (CID 90602796) is 2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide.

What is the SMILES notation for 2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide?

The canonical SMILES for 2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide is CCOc1ccc2ccccc2c1C(=O)Nc1nnc(-c2csc(C)n2)o1.

What is the InChIKey of 2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide?

The InChIKey is ZDWTZPWBNCPNBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O3S/c1-3-25-15-9-8-12-6-4-5-7-13(12)16(15)17(24)21-19-23-22-18(26-19)14-10-27-11(2)20-14/h4-10H,3H2,1-2H3,(H,21,23,24).

What are the key properties of 2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide?

2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide has a molecular weight of 380.43 g/mol, XLogP of 4.31, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide is sourced from PubChem (CID 90602796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).