N-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide

C24H27N3O3S — CID 17449333

IUPACN-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide
SMILESO=C(CN(Cc1ccco1)Cc1cccs1)Nc1ccccc1C(=O)NC1CCCC1
InChIInChI=1S/C24H27N3O3S/c28-23(17-27(15-19-9-5-13-30-19)16-20-10-6-14-31-20)26-22-12-4-3-11-21(22)24(29)25-18-7-1-2-8-18/h3-6,9-14,18H,1-2,7-8,15-17H2,(H,25,29)(H,26,28)
InChIKeyWKZOXPBOXJVTTP-UHFFFAOYSA-N
MW437.57 g/mol
LogP4.65
Rot. Bonds9

About N-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide

N-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide (PubChem CID 17449333) has the molecular formula C24H27N3O3S and a molecular weight of 437.57 g/mol. Its IUPAC name is N-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide
PubChem CID17449333
Molecular FormulaC24H27N3O3S
Molecular Weight437.57 g/mol
Exact Mass437.18
IUPAC NameN-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide
SMILESO=C(CN(Cc1ccco1)Cc1cccs1)Nc1ccccc1C(=O)NC1CCCC1
InChIInChI=1S/C24H27N3O3S/c28-23(17-27(15-19-9-5-13-30-19)16-20-10-6-14-31-20)26-22-12-4-3-11-21(22)24(29)25-18-7-1-2-8-18/h3-6,9-14,18H,1-2,7-8,15-17H2,(H,25,29)(H,26,28)
InChIKeyWKZOXPBOXJVTTP-UHFFFAOYSA-N
XLogP4.65
TPSA74.58 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.57
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide with MolForge

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Related Compounds

N-cyclopropyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide
CID 17426015
N-(cyclopropylcarbamoyl)-2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide
CID 8678412
N-(2,3-dimethylphenyl)-2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide
CID 8677595
2-[bis(furan-2-ylmethyl)amino]-N-cycloheptylacetamide
CID 27118894
[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl] 3-thiophen-2-ylpropanoate
CID 8529123
[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl] 2-thiophen-2-ylacetate
CID 24557188
N-(4-chlorophenyl)-2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide
CID 8677854
N-cyclopropyl-4-[[furan-2-ylmethyl-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]methyl]benzamide
CID 30798285
N-(2,6-dimethylphenyl)-2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide
CID 8677649
4-[[[2-(2-bromoanilino)-2-oxoethyl]-(furan-2-ylmethyl)amino]methyl]-N-cyclopropylbenzamide
CID 34943710
N-cyclopentyl-2-[[2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetyl]amino]benzamide
CID 24664133
3-cyclohexyl-1-(furan-2-ylmethyl)-1-(2-thiophen-2-ylethyl)urea
CID 90495795

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide?
The IUPAC name of N-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide (CID 17449333) is N-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide.
What is the SMILES notation for N-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide?
The canonical SMILES for N-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide is O=C(CN(Cc1ccco1)Cc1cccs1)Nc1ccccc1C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide?
The InChIKey is WKZOXPBOXJVTTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O3S/c28-23(17-27(15-19-9-5-13-30-19)16-20-10-6-14-31-20)26-22-12-4-3-11-21(22)24(29)25-18-7-1-2-8-18/h3-6,9-14,18H,1-2,7-8,15-17H2,(H,25,29)(H,26,28).
What are the key properties of N-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide?
N-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide has a molecular weight of 437.57 g/mol, XLogP of 4.65, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[[2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetyl]amino]benzamide is sourced from PubChem (CID 17449333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).