2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide

C18H24N2O4 — CID 20861823

IUPAC2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide
SMILESCC(C)OCCCNC(=O)COc1cc(=O)n(C)c2ccccc12
InChIInChI=1S/C18H24N2O4/c1-13(2)23-10-6-9-19-17(21)12-24-16-11-18(22)20(3)15-8-5-4-7-14(15)16/h4-5,7-8,11,13H,6,9-10,12H2,1-3H3,(H,19,21)
InChIKeyFPIZUCVNMDAWFN-UHFFFAOYSA-N
MW332.40 g/mol
LogP1.85
Rot. Bonds8

About 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide

2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide (PubChem CID 20861823) has the molecular formula C18H24N2O4 and a molecular weight of 332.40 g/mol. Its IUPAC name is 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide.

Molecular Properties

Compound Name2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide
PubChem CID20861823
Molecular FormulaC18H24N2O4
Molecular Weight332.40 g/mol
Exact Mass332.17
IUPAC Name2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide
SMILESCC(C)OCCCNC(=O)COc1cc(=O)n(C)c2ccccc12
InChIInChI=1S/C18H24N2O4/c1-13(2)23-10-6-9-19-17(21)12-24-16-11-18(22)20(3)15-8-5-4-7-14(15)16/h4-5,7-8,11,13H,6,9-10,12H2,1-3H3,(H,19,21)
InChIKeyFPIZUCVNMDAWFN-UHFFFAOYSA-N
XLogP1.85
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide?
The IUPAC name of 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide (CID 20861823) is 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide.
What is the SMILES notation for 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide?
The canonical SMILES for 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide is CC(C)OCCCNC(=O)COc1cc(=O)n(C)c2ccccc12.
What is the InChIKey of 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide?
The InChIKey is FPIZUCVNMDAWFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O4/c1-13(2)23-10-6-9-19-17(21)12-24-16-11-18(22)20(3)15-8-5-4-7-14(15)16/h4-5,7-8,11,13H,6,9-10,12H2,1-3H3,(H,19,21).
What are the key properties of 2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide?
2-(1-methyl-2-oxoquinolin-4-yl)oxy-N-(3-propan-2-yloxypropyl)acetamide has a molecular weight of 332.40 g/mol, XLogP of 1.85, 8 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-(3-propan-2-yloxypropyl)acetamide is sourced from PubChem (CID 20861823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).