2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide

C23H20N2O3 — CID 25162680

IUPAC2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide
SMILESCN(CCOc1ccccc1)C(=O)c1cc(-c2ccco2)nc2ccccc12
InChIInChI=1S/C23H20N2O3/c1-25(13-15-27-17-8-3-2-4-9-17)23(26)19-16-21(22-12-7-14-28-22)24-20-11-6-5-10-18(19)20/h2-12,14,16H,13,15H2,1H3
InChIKeyXJHYWPPVYPQWRD-UHFFFAOYSA-N
MW372.42 g/mol
LogP4.65
Rot. Bonds6

About 2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide

2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide (PubChem CID 25162680) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide
PubChem CID25162680
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC Name2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide
SMILESCN(CCOc1ccccc1)C(=O)c1cc(-c2ccco2)nc2ccccc12
InChIInChI=1S/C23H20N2O3/c1-25(13-15-27-17-8-3-2-4-9-17)23(26)19-16-21(22-12-7-14-28-22)24-20-11-6-5-10-18(19)20/h2-12,14,16H,13,15H2,1H3
InChIKeyXJHYWPPVYPQWRD-UHFFFAOYSA-N
XLogP4.65
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide?
The IUPAC name of 2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide (CID 25162680) is 2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide is CN(CCOc1ccccc1)C(=O)c1cc(-c2ccco2)nc2ccccc12.
What is the InChIKey of 2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide?
The InChIKey is XJHYWPPVYPQWRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3/c1-25(13-15-27-17-8-3-2-4-9-17)23(26)19-16-21(22-12-7-14-28-22)24-20-11-6-5-10-18(19)20/h2-12,14,16H,13,15H2,1H3.
What are the key properties of 2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide?
2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide has a molecular weight of 372.42 g/mol, XLogP of 4.65, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-N-methyl-N-(2-phenoxyethyl)quinoline-4-carboxamide is sourced from PubChem (CID 25162680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).