N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide

C16H14N2O4 — CID 140833669

IUPACN-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide
SMILESCC(=O)NC1=C(O)C(=O)C(C)(c2ccc3ccccc3n2)O1
InChIInChI=1S/C16H14N2O4/c1-9(19)17-15-13(20)14(21)16(2,22-15)12-8-7-10-5-3-4-6-11(10)18-12/h3-8,20H,1-2H3,(H,17,19)
InChIKeyBULMWQAEPGUIOD-UHFFFAOYSA-N
MW298.30 g/mol
LogP1.91
Rot. Bonds2

About N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide

N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide (PubChem CID 140833669) has the molecular formula C16H14N2O4 and a molecular weight of 298.30 g/mol. Its IUPAC name is N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide.

Molecular Properties

Compound NameN-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide
PubChem CID140833669
Molecular FormulaC16H14N2O4
Molecular Weight298.30 g/mol
Exact Mass298.10
IUPAC NameN-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide
SMILESCC(=O)NC1=C(O)C(=O)C(C)(c2ccc3ccccc3n2)O1
InChIInChI=1S/C16H14N2O4/c1-9(19)17-15-13(20)14(21)16(2,22-15)12-8-7-10-5-3-4-6-11(10)18-12/h3-8,20H,1-2H3,(H,17,19)
InChIKeyBULMWQAEPGUIOD-UHFFFAOYSA-N
XLogP1.91
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.30
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-(2,6-dichlorophenyl)-3-hydroxy-5-methyl-4-oxofuran-2-yl]acetamide
CID 140834203
N-(3-hydroxy-5-methyl-4-oxo-5-pyridin-3-ylfuran-2-yl)acetamide
CID 140834179
(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)carbamic acid
CID 151957017
(3R)-2,2-dimethyl-3-quinolin-2-yl-1,4-benzodioxin-3-ol
CID 2303816
(3S)-2,2-dimethyl-3-quinolin-2-yl-1-benzofuran-3-ol
CID 682922
(2-methyl-3-quinolin-2-yl-2H-1,4-benzodioxin-3-yl) acetate
CID 23770695
N-[4-[5,5-dimethyl-4-oxo-3-[4-(quinolin-2-ylmethoxy)phenyl]oxolan-2-yl]phenyl]acetamide
CID 70250449
N-[4-(quinolin-2-ylmethoxy)phenyl]acetamide
CID 2747568
[2-(ethoxycarbonylamino)-5-methyl-4-oxo-5-quinolin-3-ylfuran-3-yl] acetate
CID 140833877
N-(1-quinolin-2-ylcyclohexyl)propanamide
CID 137371294
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]quinoline-2-carboxamide
CID 103762543
9-oxo-3-quinolin-2-yl-9λ4-thiabicyclo[3.3.1]nonan-3-ol
CID 171956202

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide?
The IUPAC name of N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide (CID 140833669) is N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide.
What is the SMILES notation for N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide?
The canonical SMILES for N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide is CC(=O)NC1=C(O)C(=O)C(C)(c2ccc3ccccc3n2)O1.
What is the InChIKey of N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide?
The InChIKey is BULMWQAEPGUIOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O4/c1-9(19)17-15-13(20)14(21)16(2,22-15)12-8-7-10-5-3-4-6-11(10)18-12/h3-8,20H,1-2H3,(H,17,19).
What are the key properties of N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide?
N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide has a molecular weight of 298.30 g/mol, XLogP of 1.91, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-2-ylfuran-2-yl)acetamide is sourced from PubChem (CID 140833669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).