N-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide

C19H20N2O4 — CID 12836959

IUPACN-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide
SMILESCN(Cc1ccco1)C(=O)CCCOc1ccc2[nH]c(=O)ccc2c1
InChIInChI=1S/C19H20N2O4/c1-21(13-16-4-2-10-25-16)19(23)5-3-11-24-15-7-8-17-14(12-15)6-9-18(22)20-17/h2,4,6-10,12H,3,5,11,13H2,1H3,(H,20,22)
InChIKeyYHWUIUSNBCCCOR-UHFFFAOYSA-N
MW340.38 g/mol
LogP2.94
Rot. Bonds7

About N-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide

N-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide (PubChem CID 12836959) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide
PubChem CID12836959
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC NameN-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide
SMILESCN(Cc1ccco1)C(=O)CCCOc1ccc2[nH]c(=O)ccc2c1
InChIInChI=1S/C19H20N2O4/c1-21(13-16-4-2-10-25-16)19(23)5-3-11-24-15-7-8-17-14(12-15)6-9-18(22)20-17/h2,4,6-10,12H,3,5,11,13H2,1H3,(H,20,22)
InChIKeyYHWUIUSNBCCCOR-UHFFFAOYSA-N
XLogP2.94
TPSA75.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide with MolForge

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Related Compounds

N-cyclopropyl-N-ethyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide
CID 13112648
5-bromo-N-(furan-2-ylmethyl)-N-methylpentanamide
CID 107908125
N-(furan-2-ylmethyl)-N-methyl-2-(4-propoxyphenoxy)acetamide
CID 112775334
N-cyclohexyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]-N-(2-phenylethyl)butanamide
CID 15572912
6-(2-chloroethoxy)-1H-quinolin-2-one
CID 20540025
2-[cyclohexyl-[4-[(2-oxo-1H-quinolin-6-yl)oxy]butanoyl]amino]ethyl butanoate
CID 13107965
N-(furan-2-ylmethyl)-2-(3-methoxyphenoxy)-N-methylacetamide
CID 112779308
2-(3-aminophenoxy)-N-(furan-2-ylmethyl)-N-methylacetamide
CID 54916005
4-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylbutanamide
CID 18109840
N-(cyclohexylmethyl)-5-[(2-oxo-1H-quinolin-6-yl)oxy]-N-(2-sulfanylethyl)pentanamide
CID 14747781
N-(1-cyclopentylpropan-2-yl)-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide
CID 20563579
N-(furan-2-ylmethyl)-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 1459061

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide?
The IUPAC name of N-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide (CID 12836959) is N-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide is CN(Cc1ccco1)C(=O)CCCOc1ccc2[nH]c(=O)ccc2c1.
What is the InChIKey of N-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide?
The InChIKey is YHWUIUSNBCCCOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-21(13-16-4-2-10-25-16)19(23)5-3-11-24-15-7-8-17-14(12-15)6-9-18(22)20-17/h2,4,6-10,12H,3,5,11,13H2,1H3,(H,20,22).
What are the key properties of N-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide?
N-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide has a molecular weight of 340.38 g/mol, XLogP of 2.94, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide is sourced from PubChem (CID 12836959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).