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

C18H14N4O3S — CID 90602900

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

3-methoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-2-carboxamide (PubChem CID 90602900) has the molecular formula C18H14N4O3S and a molecular weight of 366.40 g/mol. Its IUPAC name is 3-methoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-2-carboxamide.

Molecular Properties

• Compound Name: 3-methoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-2-carboxamide
• PubChem CID: 90602900
• Molecular Formula: C18H14N4O3S
• Molecular Weight: 366.40 g/mol
• Exact Mass: 366.08
• IUPAC Name: 3-methoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-2-carboxamide
• SMILES: COc1cc2ccccc2cc1C(=O)Nc1nnc(-c2csc(C)n2)o1
• InChI: InChI=1S/C18H14N4O3S/c1-10-19-14(9-26-10)17-21-22-18(25-17)20-16(23)13-7-11-5-3-4-6-12(11)8-15(13)24-2/h3-9H,1-2H3,(H,20,22,23)
• InChIKey: PEBUOWOOYWRUGU-UHFFFAOYSA-N
• XLogP: 3.92
• TPSA: 90.14 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 4
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	366.40
LogP ≤ 5	3.92
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

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

The IUPAC name of 3-methoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-2-carboxamide (CID 90602900) is 3-methoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-2-carboxamide.

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

The canonical SMILES for 3-methoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-2-carboxamide is COc1cc2ccccc2cc1C(=O)Nc1nnc(-c2csc(C)n2)o1.

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

The InChIKey is PEBUOWOOYWRUGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O3S/c1-10-19-14(9-26-10)17-21-22-18(25-17)20-16(23)13-7-11-5-3-4-6-12(11)8-15(13)24-2/h3-9H,1-2H3,(H,20,22,23).

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

3-methoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-2-carboxamide has a molecular weight of 366.40 g/mol, XLogP of 3.92, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 3-methoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-2-carboxamide is sourced from PubChem (CID 90602900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).