N-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide

C18H22N2O3 — CID 3242451

IUPACN-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide
SMILESCn1c(=O)cc(OCC(=O)NC2CCCCC2)c2ccccc21
InChIInChI=1S/C18H22N2O3/c1-20-15-10-6-5-9-14(15)16(11-18(20)22)23-12-17(21)19-13-7-3-2-4-8-13/h5-6,9-11,13H,2-4,7-8,12H2,1H3,(H,19,21)
InChIKeyNSTLGZQAOOTSFY-UHFFFAOYSA-N
MW314.38 g/mol
LogP2.37
Rot. Bonds4

About N-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide

N-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide (PubChem CID 3242451) has the molecular formula C18H22N2O3 and a molecular weight of 314.38 g/mol. Its IUPAC name is N-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide
PubChem CID3242451
Molecular FormulaC18H22N2O3
Molecular Weight314.38 g/mol
Exact Mass314.16
IUPAC NameN-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide
SMILESCn1c(=O)cc(OCC(=O)NC2CCCCC2)c2ccccc21
InChIInChI=1S/C18H22N2O3/c1-20-15-10-6-5-9-14(15)16(11-18(20)22)23-12-17(21)19-13-7-3-2-4-8-13/h5-6,9-11,13H,2-4,7-8,12H2,1H3,(H,19,21)
InChIKeyNSTLGZQAOOTSFY-UHFFFAOYSA-N
XLogP2.37
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.38
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide?
The IUPAC name of N-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide (CID 3242451) is N-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide.
What is the SMILES notation for N-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide?
The canonical SMILES for N-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide is Cn1c(=O)cc(OCC(=O)NC2CCCCC2)c2ccccc21.
What is the InChIKey of N-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide?
The InChIKey is NSTLGZQAOOTSFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3/c1-20-15-10-6-5-9-14(15)16(11-18(20)22)23-12-17(21)19-13-7-3-2-4-8-13/h5-6,9-11,13H,2-4,7-8,12H2,1H3,(H,19,21).
What are the key properties of N-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide?
N-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide has a molecular weight of 314.38 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide is sourced from PubChem (CID 3242451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).