N-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide

C24H26N4O4 — CID 54834695

IUPACN-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide
SMILESCCCNC(=O)c1ccc(NC(=O)CNc2cccc(C(=O)NCc3ccco3)c2)cc1
InChIInChI=1S/C24H26N4O4/c1-2-12-25-23(30)17-8-10-19(11-9-17)28-22(29)16-26-20-6-3-5-18(14-20)24(31)27-15-21-7-4-13-32-21/h3-11,13-14,26H,2,12,15-16H2,1H3,(H,25,30)(H,27,31)(H,28,29)
InChIKeyTUEGFFGCUWYGKS-UHFFFAOYSA-N
MW434.50 g/mol
LogP3.40
Rot. Bonds10

About N-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide

N-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide (PubChem CID 54834695) has the molecular formula C24H26N4O4 and a molecular weight of 434.50 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide
PubChem CID54834695
Molecular FormulaC24H26N4O4
Molecular Weight434.50 g/mol
Exact Mass434.20
IUPAC NameN-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide
SMILESCCCNC(=O)c1ccc(NC(=O)CNc2cccc(C(=O)NCc3ccco3)c2)cc1
InChIInChI=1S/C24H26N4O4/c1-2-12-25-23(30)17-8-10-19(11-9-17)28-22(29)16-26-20-6-3-5-18(14-20)24(31)27-15-21-7-4-13-32-21/h3-11,13-14,26H,2,12,15-16H2,1H3,(H,25,30)(H,27,31)(H,28,29)
InChIKeyTUEGFFGCUWYGKS-UHFFFAOYSA-N
XLogP3.40
TPSA112.47 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.50
LogP ≤ 53.40
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze N-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[[2-[4-(butanoylamino)anilino]-2-oxoethyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 54834580
N-(furan-2-ylmethyl)-3-[[2-(4-methylanilino)-2-oxoethyl]amino]benzamide
CID 54834687
3-[[2-[4-(diethylcarbamoyl)anilino]-2-oxoethyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 54834424
3-[[2-[4-(furan-2-ylmethylcarbamoyl)anilino]-2-oxoethyl]amino]-N,N-dimethylbenzamide
CID 54840551
3-[[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 54834396
3-[[2-(4-fluoroanilino)-2-oxoethyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 54834477
4-[[2-(3-acetamidoanilino)acetyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 54831561
N-(furan-2-ylmethyl)-3-[[2-(3-methylanilino)acetyl]amino]benzamide
CID 54810881
3-[[2-[3-(furan-2-ylmethylcarbamoyl)anilino]-2-oxoethyl]amino]-N-methylbenzamide
CID 54839990
N-tert-butyl-3-[[2-[4-(furan-2-ylmethylcarbamoyl)anilino]acetyl]amino]benzamide
CID 54842839
N-(furan-2-ylmethyl)-3-[[2-[4-methyl-3-(propanoylamino)anilino]-2-oxoethyl]amino]benzamide
CID 54834584
3-[[2-[4-(furan-2-ylmethylcarbamoyl)anilino]acetyl]amino]-N,N-dipropylbenzamide
CID 54843114

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide?
The IUPAC name of N-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide (CID 54834695) is N-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide?
The canonical SMILES for N-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide is CCCNC(=O)c1ccc(NC(=O)CNc2cccc(C(=O)NCc3ccco3)c2)cc1.
What is the InChIKey of N-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide?
The InChIKey is TUEGFFGCUWYGKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O4/c1-2-12-25-23(30)17-8-10-19(11-9-17)28-22(29)16-26-20-6-3-5-18(14-20)24(31)27-15-21-7-4-13-32-21/h3-11,13-14,26H,2,12,15-16H2,1H3,(H,25,30)(H,27,31)(H,28,29).
What are the key properties of N-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide?
N-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide has a molecular weight of 434.50 g/mol, XLogP of 3.40, 10 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-3-[[2-oxo-2-[4-(propylcarbamoyl)anilino]ethyl]amino]benzamide is sourced from PubChem (CID 54834695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).