N-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide

C20H25N5O5 — CID 8779537

IUPACN-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide
SMILESCCN(CC(=O)NC(=O)NCc1ccco1)CC(=O)Nc1ccc(NC(C)=O)cc1
InChIInChI=1S/C20H25N5O5/c1-3-25(13-19(28)24-20(29)21-11-17-5-4-10-30-17)12-18(27)23-16-8-6-15(7-9-16)22-14(2)26/h4-10H,3,11-13H2,1-2H3,(H,22,26)(H,23,27)(H2,21,24,28,29)
InChIKeyNPDPMTNZCCFDRQ-UHFFFAOYSA-N
MW415.45 g/mol
LogP1.52
Rot. Bonds9

About N-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide

N-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide (PubChem CID 8779537) has the molecular formula C20H25N5O5 and a molecular weight of 415.45 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide
PubChem CID8779537
Molecular FormulaC20H25N5O5
Molecular Weight415.45 g/mol
Exact Mass415.19
IUPAC NameN-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide
SMILESCCN(CC(=O)NC(=O)NCc1ccco1)CC(=O)Nc1ccc(NC(C)=O)cc1
InChIInChI=1S/C20H25N5O5/c1-3-25(13-19(28)24-20(29)21-11-17-5-4-10-30-17)12-18(27)23-16-8-6-15(7-9-16)22-14(2)26/h4-10H,3,11-13H2,1-2H3,(H,22,26)(H,23,27)(H2,21,24,28,29)
InChIKeyNPDPMTNZCCFDRQ-UHFFFAOYSA-N
XLogP1.52
TPSA132.78 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.45
LogP ≤ 51.52
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Related Compounds

2-(dipropylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 43061736
[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 4-acetamidobenzoate
CID 7949805
N-(furan-2-ylmethylcarbamoyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 60691736
N-ethyl-2-[ethyl-[2-(furan-2-ylmethylamino)-2-oxoethyl]amino]acetamide
CID 26519118
[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 2-(4-acetamidophenyl)sulfanylacetate
CID 2998047
N-(furan-2-ylmethylcarbamoyl)-2-[N-(2-hydroxypropyl)anilino]acetamide
CID 51106343
2-[[2-(4-acetamidoanilino)-2-oxoethyl]-ethylamino]-N-(4-methylphenyl)acetamide
CID 8779968
ethyl 2-[[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]-methylamino]acetate
CID 62011616
N-(furan-2-ylmethyl)-2-[[2-(4-methoxyanilino)-2-oxoethyl]-methylamino]acetamide
CID 9222820
2-[[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]-methylamino]propanoic acid
CID 62637062
2-[bis(furan-2-ylmethyl)amino]-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide
CID 27118860
N-(furan-2-ylmethyl)acetamide
CID 2394850

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide (CID 8779537) is N-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide is CCN(CC(=O)NC(=O)NCc1ccco1)CC(=O)Nc1ccc(NC(C)=O)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide?
The InChIKey is NPDPMTNZCCFDRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O5/c1-3-25(13-19(28)24-20(29)21-11-17-5-4-10-30-17)12-18(27)23-16-8-6-15(7-9-16)22-14(2)26/h4-10H,3,11-13H2,1-2H3,(H,22,26)(H,23,27)(H2,21,24,28,29).
What are the key properties of N-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide?
N-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide has a molecular weight of 415.45 g/mol, XLogP of 1.52, 9 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-[ethyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]acetamide is sourced from PubChem (CID 8779537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).