N-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide

C16H18N2O3 — CID 75455773

IUPACN-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide
SMILESCCN(C(=O)CNC(=O)c1ccoc1C)c1ccccc1
InChIInChI=1S/C16H18N2O3/c1-3-18(13-7-5-4-6-8-13)15(19)11-17-16(20)14-9-10-21-12(14)2/h4-10H,3,11H2,1-2H3,(H,17,20)
InChIKeyGMGYSQRBCIXUAE-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.37
Rot. Bonds5

About N-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide

N-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide (PubChem CID 75455773) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide
PubChem CID75455773
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide
SMILESCCN(C(=O)CNC(=O)c1ccoc1C)c1ccccc1
InChIInChI=1S/C16H18N2O3/c1-3-18(13-7-5-4-6-8-13)15(19)11-17-16(20)14-9-10-21-12(14)2/h4-10H,3,11H2,1-2H3,(H,17,20)
InChIKeyGMGYSQRBCIXUAE-UHFFFAOYSA-N
XLogP2.37
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(N-ethylanilino)-2-oxoethyl]benzamide
CID 15890379
N,N'-diethyl-N,N'-diphenylpropanediamide
CID 14847934
N-(2,2-diphenylethyl)-2-methylfuran-3-carboxamide
CID 78808962
3,4-dichloro-N-[2-(N-ethylanilino)-2-oxoethyl]benzamide
CID 112996883
N-[2-(N-ethylanilino)-2-oxoethyl]cyclopropanecarboxamide
CID 47327202
N-[2-[(1,3-diphenylpyrazol-4-yl)methyl-methylamino]-2-oxoethyl]-2-methylfuran-3-carboxamide
CID 52669106
N-(2-bromo-2-phenylethyl)-2-methylfuran-3-carboxamide
CID 113274151
2-methyl-N-pentylfuran-3-carboxamide
CID 4127379
N-ethyl-N-phenyl-2-(1-phenylpropylamino)acetamide
CID 54845115
N-ethyl-2-(2-methylphenyl)-N-phenylacetamide
CID 113098481
N-[2-[2-(4-benzylpiperazin-1-yl)ethylamino]-2-oxoethyl]-2-methylfuran-3-carboxamide
CID 55841381
2-[[2-(N-ethylanilino)-2-oxoethyl]amino]-2-methylpropanoic acid
CID 65263468

Frequently Asked Questions

What is the IUPAC name of N-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide?
The IUPAC name of N-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide (CID 75455773) is N-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide?
The canonical SMILES for N-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide is CCN(C(=O)CNC(=O)c1ccoc1C)c1ccccc1.
What is the InChIKey of N-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide?
The InChIKey is GMGYSQRBCIXUAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-3-18(13-7-5-4-6-8-13)15(19)11-17-16(20)14-9-10-21-12(14)2/h4-10H,3,11H2,1-2H3,(H,17,20).
What are the key properties of N-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide?
N-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(N-ethylanilino)-2-oxoethyl]-2-methylfuran-3-carboxamide is sourced from PubChem (CID 75455773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).