N-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide

C20H26N2O3 — CID 3239727

IUPACN-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide
SMILESCCn1c(=O)cc(OCC(=O)N(C)C2CCCCC2)c2ccccc21
InChIInChI=1S/C20H26N2O3/c1-3-22-17-12-8-7-11-16(17)18(13-19(22)23)25-14-20(24)21(2)15-9-5-4-6-10-15/h7-8,11-13,15H,3-6,9-10,14H2,1-2H3
InChIKeyXLWOLOXPEMSBPY-UHFFFAOYSA-N
MW342.44 g/mol
LogP3.19
Rot. Bonds5

About N-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide

N-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide (PubChem CID 3239727) has the molecular formula C20H26N2O3 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide
PubChem CID3239727
Molecular FormulaC20H26N2O3
Molecular Weight342.44 g/mol
Exact Mass342.19
IUPAC NameN-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide
SMILESCCn1c(=O)cc(OCC(=O)N(C)C2CCCCC2)c2ccccc21
InChIInChI=1S/C20H26N2O3/c1-3-22-17-12-8-7-11-16(17)18(13-19(22)23)25-14-20(24)21(2)15-9-5-4-6-10-15/h7-8,11-13,15H,3-6,9-10,14H2,1-2H3
InChIKeyXLWOLOXPEMSBPY-UHFFFAOYSA-N
XLogP3.19
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide?
The IUPAC name of N-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide (CID 3239727) is N-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide.
What is the SMILES notation for N-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide?
The canonical SMILES for N-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide is CCn1c(=O)cc(OCC(=O)N(C)C2CCCCC2)c2ccccc21.
What is the InChIKey of N-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide?
The InChIKey is XLWOLOXPEMSBPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3/c1-3-22-17-12-8-7-11-16(17)18(13-19(22)23)25-14-20(24)21(2)15-9-5-4-6-10-15/h7-8,11-13,15H,3-6,9-10,14H2,1-2H3.
What are the key properties of N-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide?
N-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide has a molecular weight of 342.44 g/mol, XLogP of 3.19, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxy-N-methylacetamide is sourced from PubChem (CID 3239727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).