(1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate

C20H18N2O5 — CID 47019047

IUPAC(1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate
SMILESCC(OC(=O)c1ccc(Cn2ccccc2=O)o1)C(=O)Nc1ccccc1
InChIInChI=1S/C20H18N2O5/c1-14(19(24)21-15-7-3-2-4-8-15)26-20(25)17-11-10-16(27-17)13-22-12-6-5-9-18(22)23/h2-12,14H,13H2,1H3,(H,21,24)
InChIKeyRHEUFRZNAFORTG-UHFFFAOYSA-N
MW366.37 g/mol
LogP2.67
Rot. Bonds6

About (1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate

(1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate (PubChem CID 47019047) has the molecular formula C20H18N2O5 and a molecular weight of 366.37 g/mol. Its IUPAC name is (1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate.

Molecular Properties

Compound Name(1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate
PubChem CID47019047
Molecular FormulaC20H18N2O5
Molecular Weight366.37 g/mol
Exact Mass366.12
IUPAC Name(1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate
SMILESCC(OC(=O)c1ccc(Cn2ccccc2=O)o1)C(=O)Nc1ccccc1
InChIInChI=1S/C20H18N2O5/c1-14(19(24)21-15-7-3-2-4-8-15)26-20(25)17-11-10-16(27-17)13-22-12-6-5-9-18(22)23/h2-12,14H,13H2,1H3,(H,21,24)
InChIKeyRHEUFRZNAFORTG-UHFFFAOYSA-N
XLogP2.67
TPSA90.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.37
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate with MolForge

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Related Compounds

N-[(2R)-3-methylbutan-2-yl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 30597946
N-[(2S)-3-methylbutan-2-yl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 30597949
N-[2-(2-methylpropanoylamino)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 31344363
N-(2-methylpropyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 47141529
N-(4-tert-butylphenyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 134024272
N-(4-ethylsulfonylphenyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 39863132
[(2R)-1-(4-chloroanilino)-1-oxopropan-2-yl] 5-(phenoxymethyl)furan-2-carboxylate
CID 7893043
N-[4-(difluoromethoxy)phenyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 31328902
N'-[(2R)-2-(4-ethoxyphenoxy)propanoyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide
CID 32805465
[1-(2-fluoroanilino)-1-oxopropan-2-yl] 5-(pyrazol-1-ylmethyl)furan-2-carboxylate
CID 55646692
[(2R)-1-(4-cyanoanilino)-1-oxopropan-2-yl] 5-(phenoxymethyl)furan-2-carboxylate
CID 7893045
N-[(2R)-1-ethoxy-3-methylbutan-2-yl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 124851092

Frequently Asked Questions

What is the IUPAC name of (1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate?
The IUPAC name of (1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate (CID 47019047) is (1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate.
What is the SMILES notation for (1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate?
The canonical SMILES for (1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate is CC(OC(=O)c1ccc(Cn2ccccc2=O)o1)C(=O)Nc1ccccc1.
What is the InChIKey of (1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate?
The InChIKey is RHEUFRZNAFORTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O5/c1-14(19(24)21-15-7-3-2-4-8-15)26-20(25)17-11-10-16(27-17)13-22-12-6-5-9-18(22)23/h2-12,14H,13H2,1H3,(H,21,24).
What are the key properties of (1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate?
(1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate has a molecular weight of 366.37 g/mol, XLogP of 2.67, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1-anilino-1-oxopropan-2-yl) 5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxylate is sourced from PubChem (CID 47019047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).