2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide

C20H20N2O3 — CID 17012319

IUPAC2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide
SMILESCOc1ccccc1OC(C)C(=O)Nc1cccc2ccc(C)nc12
InChIInChI=1S/C20H20N2O3/c1-13-11-12-15-7-6-8-16(19(15)21-13)22-20(23)14(2)25-18-10-5-4-9-17(18)24-3/h4-12,14H,1-3H3,(H,22,23)
InChIKeyHYNUWHKKYPMYAF-UHFFFAOYSA-N
MW336.39 g/mol
LogP3.96
Rot. Bonds5

About 2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide

2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide (PubChem CID 17012319) has the molecular formula C20H20N2O3 and a molecular weight of 336.39 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide
PubChem CID17012319
Molecular FormulaC20H20N2O3
Molecular Weight336.39 g/mol
Exact Mass336.15
IUPAC Name2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide
SMILESCOc1ccccc1OC(C)C(=O)Nc1cccc2ccc(C)nc12
InChIInChI=1S/C20H20N2O3/c1-13-11-12-15-7-6-8-16(19(15)21-13)22-20(23)14(2)25-18-10-5-4-9-17(18)24-3/h4-12,14H,1-3H3,(H,22,23)
InChIKeyHYNUWHKKYPMYAF-UHFFFAOYSA-N
XLogP3.96
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide (CID 17012319) is 2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide is COc1ccccc1OC(C)C(=O)Nc1cccc2ccc(C)nc12.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide?
The InChIKey is HYNUWHKKYPMYAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O3/c1-13-11-12-15-7-6-8-16(19(15)21-13)22-20(23)14(2)25-18-10-5-4-9-17(18)24-3/h4-12,14H,1-3H3,(H,22,23).
What are the key properties of 2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide?
2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide has a molecular weight of 336.39 g/mol, XLogP of 3.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)propanamide is sourced from PubChem (CID 17012319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).