2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide

C20H26N4O4 — CID 8684008

IUPAC2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide
SMILESCCNC(=O)CN(CC)CC(=O)Nc1ccccc1C(=O)NCc1ccco1
InChIInChI=1S/C20H26N4O4/c1-3-21-18(25)13-24(4-2)14-19(26)23-17-10-6-5-9-16(17)20(27)22-12-15-8-7-11-28-15/h5-11H,3-4,12-14H2,1-2H3,(H,21,25)(H,22,27)(H,23,26)
InChIKeyPPMLKQOWYOASNB-UHFFFAOYSA-N
MW386.45 g/mol
LogP1.61
Rot. Bonds10

About 2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide

2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide (PubChem CID 8684008) has the molecular formula C20H26N4O4 and a molecular weight of 386.45 g/mol. Its IUPAC name is 2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide
PubChem CID8684008
Molecular FormulaC20H26N4O4
Molecular Weight386.45 g/mol
Exact Mass386.20
IUPAC Name2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide
SMILESCCNC(=O)CN(CC)CC(=O)Nc1ccccc1C(=O)NCc1ccco1
InChIInChI=1S/C20H26N4O4/c1-3-21-18(25)13-24(4-2)14-19(26)23-17-10-6-5-9-16(17)20(27)22-12-15-8-7-11-28-15/h5-11H,3-4,12-14H2,1-2H3,(H,21,25)(H,22,27)(H,23,26)
InChIKeyPPMLKQOWYOASNB-UHFFFAOYSA-N
XLogP1.61
TPSA103.68 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 51.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-[ethyl-[2-(furan-2-ylmethylamino)-2-oxoethyl]amino]acetamide
CID 26519118
2-[(2-bromoacetyl)amino]-N-(furan-2-ylmethyl)benzamide
CID 112547104
N,N'-bis[2-(furan-2-ylmethylcarbamoyl)phenyl]hexanediamide
CID 4938791
N-(furan-2-ylmethyl)-2-(heptanoylamino)benzamide
CID 36859009
N-(furan-2-ylmethyl)-2-[[2-[[2-(methylamino)-2-oxoethyl]amino]acetyl]amino]benzamide
CID 8772778
2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 34648175
2-[[2-(4-chloro-N-methylsulfonylanilino)acetyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 1317344
N-(furan-2-ylmethyl)-2-[[2-[methyl-(5-phenylpyrazolidin-3-yl)amino]acetyl]amino]benzamide
CID 52989905
N-ethyl-2-[ethyl-[2-(2-methylanilino)-2-oxoethyl]amino]acetamide
CID 9432874
2-methoxyethyl 4-[2-(furan-2-ylmethylcarbamoyl)anilino]-4-oxobutanoate
CID 17339123
2-[[2-[2-(3,5-dimethylphenoxy)ethyl-methylamino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 24507737
2-[[2-(3-fluoro-N-methylsulfonylanilino)acetyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 1305982

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
The IUPAC name of 2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide (CID 8684008) is 2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide.
What is the SMILES notation for 2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
The canonical SMILES for 2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide is CCNC(=O)CN(CC)CC(=O)Nc1ccccc1C(=O)NCc1ccco1.
What is the InChIKey of 2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
The InChIKey is PPMLKQOWYOASNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O4/c1-3-21-18(25)13-24(4-2)14-19(26)23-17-10-6-5-9-16(17)20(27)22-12-15-8-7-11-28-15/h5-11H,3-4,12-14H2,1-2H3,(H,21,25)(H,22,27)(H,23,26).
What are the key properties of 2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide has a molecular weight of 386.45 g/mol, XLogP of 1.61, 10 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide is sourced from PubChem (CID 8684008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).