[2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate

C19H24N2O4 — CID 18273291

IUPAC[2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate
SMILESCCN(C(=O)COC(=O)CNC(=O)c1ccccc1C)C1=CCCC1
InChIInChI=1S/C19H24N2O4/c1-3-21(15-9-5-6-10-15)17(22)13-25-18(23)12-20-19(24)16-11-7-4-8-14(16)2/h4,7-9,11H,3,5-6,10,12-13H2,1-2H3,(H,20,24)
InChIKeyLLOUWSSHUWEQPQ-UHFFFAOYSA-N
MW344.41 g/mol
LogP2.18
Rot. Bonds7

About [2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate

[2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate (PubChem CID 18273291) has the molecular formula C19H24N2O4 and a molecular weight of 344.41 g/mol. Its IUPAC name is [2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate.

Molecular Properties

Compound Name[2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate
PubChem CID18273291
Molecular FormulaC19H24N2O4
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC Name[2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate
SMILESCCN(C(=O)COC(=O)CNC(=O)c1ccccc1C)C1=CCCC1
InChIInChI=1S/C19H24N2O4/c1-3-21(15-9-5-6-10-15)17(22)13-25-18(23)12-20-19(24)16-11-7-4-8-14(16)2/h4,7-9,11H,3,5-6,10,12-13H2,1-2H3,(H,20,24)
InChIKeyLLOUWSSHUWEQPQ-UHFFFAOYSA-N
XLogP2.18
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[benzyl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate
CID 18267738
[2-[cyclohexen-1-yl(ethyl)amino]-2-oxoethyl] 2-acetamido-3-methylbenzoate
CID 18169986
[2-[[4-(dimethylamino)phenyl]methyl-methylamino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate
CID 46607448
[2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate
CID 46796070
[2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 3-(naphthalen-2-ylsulfonylamino)propanoate
CID 16560413
2-[2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethoxy]-4-methylbenzamide
CID 24585380
[2-(4-tert-butylphenyl)-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate
CID 18289243
ethyl 2-[(2-ethoxybenzoyl)amino]acetate
CID 4056517
[2-[cyclohexyl(ethyl)amino]-2-oxoethyl] 2-[(2-ethoxybenzoyl)amino]acetate
CID 7042884
[2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 3-methylsulfonylbenzoate
CID 18193790
[2-(N-ethylanilino)-2-oxoethyl] 2-[(5-methylthiophene-2-carbonyl)amino]acetate
CID 2399511
[2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 2-[(2-methylbenzoyl)amino]acetate
CID 46795940

Frequently Asked Questions

What is the IUPAC name of [2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate?
The IUPAC name of [2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate (CID 18273291) is [2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate.
What is the SMILES notation for [2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate?
The canonical SMILES for [2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate is CCN(C(=O)COC(=O)CNC(=O)c1ccccc1C)C1=CCCC1.
What is the InChIKey of [2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate?
The InChIKey is LLOUWSSHUWEQPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4/c1-3-21(15-9-5-6-10-15)17(22)13-25-18(23)12-20-19(24)16-11-7-4-8-14(16)2/h4,7-9,11H,3,5-6,10,12-13H2,1-2H3,(H,20,24).
What are the key properties of [2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate?
[2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate has a molecular weight of 344.41 g/mol, XLogP of 2.18, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-[(2-methylbenzoyl)amino]acetate is sourced from PubChem (CID 18273291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).