2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide

C18H17N3O3 — CID 155925752

IUPAC2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide
SMILESCOc1ccc2nc(C)cc(OCC(=O)Nc3ccncc3)c2c1
InChIInChI=1S/C18H17N3O3/c1-12-9-17(15-10-14(23-2)3-4-16(15)20-12)24-11-18(22)21-13-5-7-19-8-6-13/h3-10H,11H2,1-2H3,(H,19,21,22)
InChIKeyAJINLWOUARXNMQ-UHFFFAOYSA-N
MW323.35 g/mol
LogP2.96
Rot. Bonds5

About 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide

2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide (PubChem CID 155925752) has the molecular formula C18H17N3O3 and a molecular weight of 323.35 g/mol. Its IUPAC name is 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide.

Molecular Properties

Compound Name2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide
PubChem CID155925752
Molecular FormulaC18H17N3O3
Molecular Weight323.35 g/mol
Exact Mass323.13
IUPAC Name2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide
SMILESCOc1ccc2nc(C)cc(OCC(=O)Nc3ccncc3)c2c1
InChIInChI=1S/C18H17N3O3/c1-12-9-17(15-10-14(23-2)3-4-16(15)20-12)24-11-18(22)21-13-5-7-19-8-6-13/h3-10H,11H2,1-2H3,(H,19,21,22)
InChIKeyAJINLWOUARXNMQ-UHFFFAOYSA-N
XLogP2.96
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide?
The IUPAC name of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide (CID 155925752) is 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide.
What is the SMILES notation for 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide?
The canonical SMILES for 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide is COc1ccc2nc(C)cc(OCC(=O)Nc3ccncc3)c2c1.
What is the InChIKey of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide?
The InChIKey is AJINLWOUARXNMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c1-12-9-17(15-10-14(23-2)3-4-16(15)20-12)24-11-18(22)21-13-5-7-19-8-6-13/h3-10H,11H2,1-2H3,(H,19,21,22).
What are the key properties of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide?
2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide has a molecular weight of 323.35 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-pyridin-4-ylacetamide is sourced from PubChem (CID 155925752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).