2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide

C18H17N3O3 — CID 3243918

IUPAC2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide
SMILESCn1c(=O)cc(OCC(=O)NCc2cccnc2)c2ccccc21
InChIInChI=1S/C18H17N3O3/c1-21-15-7-3-2-6-14(15)16(9-18(21)23)24-12-17(22)20-11-13-5-4-8-19-10-13/h2-10H,11-12H2,1H3,(H,20,22)
InChIKeyIYIYKGYKAWLCAH-UHFFFAOYSA-N
MW323.35 g/mol
LogP1.63
Rot. Bonds5

About 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide

2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide (PubChem CID 3243918) has the molecular formula C18H17N3O3 and a molecular weight of 323.35 g/mol. Its IUPAC name is 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide
PubChem CID3243918
Molecular FormulaC18H17N3O3
Molecular Weight323.35 g/mol
Exact Mass323.13
IUPAC Name2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide
SMILESCn1c(=O)cc(OCC(=O)NCc2cccnc2)c2ccccc21
InChIInChI=1S/C18H17N3O3/c1-21-15-7-3-2-6-14(15)16(9-18(21)23)24-12-17(22)20-11-13-5-4-8-19-10-13/h2-10H,11-12H2,1H3,(H,20,22)
InChIKeyIYIYKGYKAWLCAH-UHFFFAOYSA-N
XLogP1.63
TPSA73.22 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 ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide?
The IUPAC name of 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide (CID 3243918) is 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide?
The canonical SMILES for 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide is Cn1c(=O)cc(OCC(=O)NCc2cccnc2)c2ccccc21.
What is the InChIKey of 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide?
The InChIKey is IYIYKGYKAWLCAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c1-21-15-7-3-2-6-14(15)16(9-18(21)23)24-12-17(22)20-11-13-5-4-8-19-10-13/h2-10H,11-12H2,1H3,(H,20,22).
What are the key properties of 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide?
2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide has a molecular weight of 323.35 g/mol, XLogP of 1.63, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(pyridin-3-ylmethyl)acetamide is sourced from PubChem (CID 3243918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).