N-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide

C19H23N3O4 — CID 55535244

IUPACN-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide
SMILESCCN(CC)C(=O)c1cccc(NC(=O)CN(C)C(=O)c2ccco2)c1
InChIInChI=1S/C19H23N3O4/c1-4-22(5-2)18(24)14-8-6-9-15(12-14)20-17(23)13-21(3)19(25)16-10-7-11-26-16/h6-12H,4-5,13H2,1-3H3,(H,20,23)
InChIKeyOVHYDGFJZXWVGH-UHFFFAOYSA-N
MW357.41 g/mol
LogP2.47
Rot. Bonds7

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

N-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide (PubChem CID 55535244) has the molecular formula C19H23N3O4 and a molecular weight of 357.41 g/mol. Its IUPAC name is N-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide
PubChem CID55535244
Molecular FormulaC19H23N3O4
Molecular Weight357.41 g/mol
Exact Mass357.17
IUPAC NameN-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide
SMILESCCN(CC)C(=O)c1cccc(NC(=O)CN(C)C(=O)c2ccco2)c1
InChIInChI=1S/C19H23N3O4/c1-4-22(5-2)18(24)14-8-6-9-15(12-14)20-17(23)13-21(3)19(25)16-10-7-11-26-16/h6-12H,4-5,13H2,1-3H3,(H,20,23)
InChIKeyOVHYDGFJZXWVGH-UHFFFAOYSA-N
XLogP2.47
TPSA82.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[(2-anilino-2-oxoethyl)-methylcarbamoyl]phenyl]furan-2-carboxamide
CID 55853540
N,N-diethyl-3-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]benzamide
CID 40700702
N-[3-[[2-(2,3-dimethylanilino)-2-oxoethyl]-methylcarbamoyl]phenyl]furan-2-carboxamide
CID 55820877
N-[3-[[2-(diethylamino)acetyl]amino]phenyl]furan-2-carboxamide
CID 54813683
[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-(furan-2-ylmethyl)-methylazanium
CID 8620955
N-[5-[[3-(diethylcarbamoyl)phenyl]carbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 31306387
N-[2-[3,5-bis(trifluoromethyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 35713339
N,N'-bis[3-(diethylcarbamoyl)phenyl]decanediamide
CID 17194651
2-[[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-methylamino]propanoic acid;hydrochloride
CID 119913546
N-benzyl-N-ethyl-3-(propanoylamino)benzamide
CID 17309573
3-[[2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]acetyl]amino]-N,N-diethylbenzamide
CID 46458841
N-[3-[ethyl(oxolan-3-ylmethyl)carbamoyl]phenyl]furan-2-carboxamide
CID 51090912

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide?
The IUPAC name of N-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide (CID 55535244) is N-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide.
What is the SMILES notation for N-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide?
The canonical SMILES for N-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide is CCN(CC)C(=O)c1cccc(NC(=O)CN(C)C(=O)c2ccco2)c1.
What is the InChIKey of N-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide?
The InChIKey is OVHYDGFJZXWVGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4/c1-4-22(5-2)18(24)14-8-6-9-15(12-14)20-17(23)13-21(3)19(25)16-10-7-11-26-16/h6-12H,4-5,13H2,1-3H3,(H,20,23).
What are the key properties of N-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide?
N-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide has a molecular weight of 357.41 g/mol, XLogP of 2.47, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-methylfuran-2-carboxamide is sourced from PubChem (CID 55535244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).