3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide

C17H16N2O3 — CID 110413242

IUPAC3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
SMILESO=C(CCc1ccco1)NCc1cc2ccccc2[nH]c1=O
InChIInChI=1S/C17H16N2O3/c20-16(8-7-14-5-3-9-22-14)18-11-13-10-12-4-1-2-6-15(12)19-17(13)21/h1-6,9-10H,7-8,11H2,(H,18,20)(H,19,21)
InChIKeyJXXNKVRFRFDIGJ-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.37
Rot. Bonds5

About 3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide

3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide (PubChem CID 110413242) has the molecular formula C17H16N2O3 and a molecular weight of 296.33 g/mol. Its IUPAC name is 3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide.

Molecular Properties

Compound Name3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
PubChem CID110413242
Molecular FormulaC17H16N2O3
Molecular Weight296.33 g/mol
Exact Mass296.12
IUPAC Name3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
SMILESO=C(CCc1ccco1)NCc1cc2ccccc2[nH]c1=O
InChIInChI=1S/C17H16N2O3/c20-16(8-7-14-5-3-9-22-14)18-11-13-10-12-4-1-2-6-15(12)19-17(13)21/h1-6,9-10H,7-8,11H2,(H,18,20)(H,19,21)
InChIKeyJXXNKVRFRFDIGJ-UHFFFAOYSA-N
XLogP2.37
TPSA75.10 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(furan-2-yl)-N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide
CID 110413804
N-[[2-(aminomethyl)phenyl]methyl]-3-(furan-2-yl)propanamide
CID 55156972
N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-(4-phenyl-1,3-thiazol-2-yl)propanamide
CID 110608858
3-(furan-2-yl)-N-[[3-[[3-(furan-2-yl)propanoylamino]methyl]phenyl]methyl]propanamide
CID 86064144
5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-5-thiophen-2-ylpentanamide
CID 110616660
3-(2-oxo-1H-quinolin-3-yl)-N-(3-phenylpropyl)propanamide
CID 110330993
N-(3-methylbutyl)-3-(2-oxo-1H-quinolin-3-yl)propanamide
CID 110330998
2-fluoro-N-(furan-2-ylmethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 2036920
2-(4-oxo-3H-phthalazin-1-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 139017463
2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110616680
2-(2,4-dichlorophenoxy)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110324293
N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
CID 110619588

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide?
The IUPAC name of 3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide (CID 110413242) is 3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide.
What is the SMILES notation for 3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide?
The canonical SMILES for 3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide is O=C(CCc1ccco1)NCc1cc2ccccc2[nH]c1=O.
What is the InChIKey of 3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide?
The InChIKey is JXXNKVRFRFDIGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O3/c20-16(8-7-14-5-3-9-22-14)18-11-13-10-12-4-1-2-6-15(12)19-17(13)21/h1-6,9-10H,7-8,11H2,(H,18,20)(H,19,21).
What are the key properties of 3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide?
3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide has a molecular weight of 296.33 g/mol, XLogP of 2.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide is sourced from PubChem (CID 110413242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).