N-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide

C23H23N3O4 — CID 35743644

IUPACN-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide
SMILESCN(CC(=O)Nc1ccccc1C(=O)NCCc1ccccc1)C(=O)c1ccco1
InChIInChI=1S/C23H23N3O4/c1-26(23(29)20-12-7-15-30-20)16-21(27)25-19-11-6-5-10-18(19)22(28)24-14-13-17-8-3-2-4-9-17/h2-12,15H,13-14,16H2,1H3,(H,24,28)(H,25,27)
InChIKeyMAUDXSPEOZQPKN-UHFFFAOYSA-N
MW405.45 g/mol
LogP2.96
Rot. Bonds8

About N-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide

N-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide (PubChem CID 35743644) has the molecular formula C23H23N3O4 and a molecular weight of 405.45 g/mol. Its IUPAC name is N-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide
PubChem CID35743644
Molecular FormulaC23H23N3O4
Molecular Weight405.45 g/mol
Exact Mass405.17
IUPAC NameN-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide
SMILESCN(CC(=O)Nc1ccccc1C(=O)NCCc1ccccc1)C(=O)c1ccco1
InChIInChI=1S/C23H23N3O4/c1-26(23(29)20-12-7-15-30-20)16-21(27)25-19-11-6-5-10-18(19)22(28)24-14-13-17-8-3-2-4-9-17/h2-12,15H,13-14,16H2,1H3,(H,24,28)(H,25,27)
InChIKeyMAUDXSPEOZQPKN-UHFFFAOYSA-N
XLogP2.96
TPSA91.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.45
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2-fluoroanilino)-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 35555182
N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]furan-2-carboxamide
CID 26897595
[(1R)-1-(furan-2-yl)ethyl]-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]azanium
CID 8922795
N-[2-[2-(dimethylsulfamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 55984585
2-[[2-[(2-phenylacetyl)amino]acetyl]amino]-N-(2-phenylethyl)benzamide
CID 33252278
N-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 35563379
[2-(2-phenylethylcarbamoyl)phenyl]carbamothioic S-acid
CID 155166285
3-[[2-[furan-2-carbonyl(methyl)amino]acetyl]amino]propanoic acid
CID 43170664
N-methyl-N-[2-[2-(2-methylfuran-3-carbonyl)hydrazinyl]-2-oxoethyl]furan-2-carboxamide
CID 43047860
2-[[2-(2-chlorophenyl)acetyl]amino]-N-(2-phenylethyl)benzamide
CID 29456122
N-[2-(2-phenylethylcarbamoyl)phenyl]furan-3-carboxamide
CID 18102051
2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-phenylethyl)benzamide;hydrochloride
CID 119676959

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide?
The IUPAC name of N-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide (CID 35743644) is N-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide.
What is the SMILES notation for N-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide?
The canonical SMILES for N-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide is CN(CC(=O)Nc1ccccc1C(=O)NCCc1ccccc1)C(=O)c1ccco1.
What is the InChIKey of N-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide?
The InChIKey is MAUDXSPEOZQPKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O4/c1-26(23(29)20-12-7-15-30-20)16-21(27)25-19-11-6-5-10-18(19)22(28)24-14-13-17-8-3-2-4-9-17/h2-12,15H,13-14,16H2,1H3,(H,24,28)(H,25,27).
What are the key properties of N-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide?
N-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide has a molecular weight of 405.45 g/mol, XLogP of 2.96, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-oxo-2-[2-(2-phenylethylcarbamoyl)anilino]ethyl]furan-2-carboxamide is sourced from PubChem (CID 35743644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).