2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide

C16H15N3O3S — CID 155924614

IUPAC2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide
SMILESCOc1ccc2nc(C)cc(OCC(=O)Nc3nccs3)c2c1
InChIInChI=1S/C16H15N3O3S/c1-10-7-14(12-8-11(21-2)3-4-13(12)18-10)22-9-15(20)19-16-17-5-6-23-16/h3-8H,9H2,1-2H3,(H,17,19,20)
InChIKeyAKBDQJRTWSKHDC-UHFFFAOYSA-N
MW329.38 g/mol
LogP3.03
Rot. Bonds5

About 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide

2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 155924614) has the molecular formula C16H15N3O3S and a molecular weight of 329.38 g/mol. Its IUPAC name is 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide
PubChem CID155924614
Molecular FormulaC16H15N3O3S
Molecular Weight329.38 g/mol
Exact Mass329.08
IUPAC Name2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide
SMILESCOc1ccc2nc(C)cc(OCC(=O)Nc3nccs3)c2c1
InChIInChI=1S/C16H15N3O3S/c1-10-7-14(12-8-11(21-2)3-4-13(12)18-10)22-9-15(20)19-16-17-5-6-23-16/h3-8H,9H2,1-2H3,(H,17,19,20)
InChIKeyAKBDQJRTWSKHDC-UHFFFAOYSA-N
XLogP3.03
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide (CID 155924614) is 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide is COc1ccc2nc(C)cc(OCC(=O)Nc3nccs3)c2c1.
What is the InChIKey of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is AKBDQJRTWSKHDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3S/c1-10-7-14(12-8-11(21-2)3-4-13(12)18-10)22-9-15(20)19-16-17-5-6-23-16/h3-8H,9H2,1-2H3,(H,17,19,20).
What are the key properties of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide?
2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 329.38 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 155924614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).