4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide

C16H18N2O3 — CID 17395333

IUPAC4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide
SMILESCCc1ccc(C(=O)NCC(=O)NCc2ccco2)cc1
InChIInChI=1S/C16H18N2O3/c1-2-12-5-7-13(8-6-12)16(20)18-11-15(19)17-10-14-4-3-9-21-14/h3-9H,2,10-11H2,1H3,(H,17,19)(H,18,20)
InChIKeyWUFOORYWNVJBTO-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.89
Rot. Bonds6

About 4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide

4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide (PubChem CID 17395333) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide
PubChem CID17395333
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide
SMILESCCc1ccc(C(=O)NCC(=O)NCc2ccco2)cc1
InChIInChI=1S/C16H18N2O3/c1-2-12-5-7-13(8-6-12)16(20)18-11-15(19)17-10-14-4-3-9-21-14/h3-9H,2,10-11H2,1H3,(H,17,19)(H,18,20)
InChIKeyWUFOORYWNVJBTO-UHFFFAOYSA-N
XLogP1.89
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-ethylanilino)-N-(furan-2-ylmethyl)acetamide
CID 37465954
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide
CID 18118956
4-(4-ethylphenyl)-N-(furan-2-ylmethyl)-4-oxobutanamide
CID 30797918
4-(dimethylsulfamoyl)-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide
CID 18118985
N-[2-[[2-(furan-2-ylmethylamino)-2-oxoethyl]amino]-2-oxoethyl]-3-methylbenzamide
CID 9079684
tert-butyl N-[4-[[2-(furan-2-ylmethylamino)-2-oxoethyl]carbamoyl]phenyl]carbamate
CID 9081148
4-(chloromethyl)-N-(furan-2-ylmethyl)benzamide
CID 43156226
N-butyl-4-[[2-(furan-2-ylmethylamino)-2-oxoethyl]amino]benzamide
CID 54832198
2-(3,4-dimethylphenyl)-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]acetamide
CID 18118941
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-1,3-benzodioxole-5-carboxamide
CID 17439553
3,5-dichloro-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-methoxybenzamide
CID 9081404
4-N-(2,6-diethylphenyl)-1-N-(furan-2-ylmethyl)benzene-1,4-dicarboxamide
CID 109046593

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide?
The IUPAC name of 4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide (CID 17395333) is 4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide.
What is the SMILES notation for 4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide?
The canonical SMILES for 4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide is CCc1ccc(C(=O)NCC(=O)NCc2ccco2)cc1.
What is the InChIKey of 4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide?
The InChIKey is WUFOORYWNVJBTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-2-12-5-7-13(8-6-12)16(20)18-11-15(19)17-10-14-4-3-9-21-14/h3-9H,2,10-11H2,1H3,(H,17,19)(H,18,20).
What are the key properties of 4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide?
4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide has a molecular weight of 286.33 g/mol, XLogP of 1.89, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzamide is sourced from PubChem (CID 17395333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).