[2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate

C17H18N2O5 — CID 2583176

IUPAC[2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate
SMILESCCNC(=O)NC(=O)COC(=O)COc1ccc2ccccc2c1
InChIInChI=1S/C17H18N2O5/c1-2-18-17(22)19-15(20)10-24-16(21)11-23-14-8-7-12-5-3-4-6-13(12)9-14/h3-9H,2,10-11H2,1H3,(H2,18,19,20,22)
InChIKeyCMWYUXOXFRTZEZ-UHFFFAOYSA-N
MW330.34 g/mol
LogP1.61
Rot. Bonds6

About [2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate

[2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate (PubChem CID 2583176) has the molecular formula C17H18N2O5 and a molecular weight of 330.34 g/mol. Its IUPAC name is [2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate.

Molecular Properties

Compound Name[2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate
PubChem CID2583176
Molecular FormulaC17H18N2O5
Molecular Weight330.34 g/mol
Exact Mass330.12
IUPAC Name[2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate
SMILESCCNC(=O)NC(=O)COC(=O)COc1ccc2ccccc2c1
InChIInChI=1S/C17H18N2O5/c1-2-18-17(22)19-15(20)10-24-16(21)11-23-14-8-7-12-5-3-4-6-13(12)9-14/h3-9H,2,10-11H2,1H3,(H2,18,19,20,22)
InChIKeyCMWYUXOXFRTZEZ-UHFFFAOYSA-N
XLogP1.61
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.34
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[2-(ethylcarbamoylamino)-2-oxoethyl] 2-(3,4-dimethylphenoxy)acetate
CID 2595886
[2-(2-acetylhydrazinyl)-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 8821296
[2-(ethylcarbamoylamino)-2-oxoethyl] 2-(2,3-dihydro-1H-inden-5-yloxy)acetate
CID 4673954
[2-(benzylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 2365439
[2-(2-methylanilino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 7843327
[2-(cyclohexylmethylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 2583275
[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 8821336
[2-(4-tert-butylanilino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 7843324
N-[2-(ethylamino)ethyl]-2-naphthalen-2-yloxyacetamide;hydrochloride
CID 119504571
[2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 9491672
[2-(ethylcarbamoylamino)-2-oxoethyl] 2-(2,4,5-trichlorophenoxy)acetate
CID 8785756
2-hydroxyethyl 2-naphthalen-2-yloxyacetate
CID 21297754

Frequently Asked Questions

What is the IUPAC name of [2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate?
The IUPAC name of [2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate (CID 2583176) is [2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate.
What is the SMILES notation for [2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate?
The canonical SMILES for [2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate is CCNC(=O)NC(=O)COC(=O)COc1ccc2ccccc2c1.
What is the InChIKey of [2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate?
The InChIKey is CMWYUXOXFRTZEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O5/c1-2-18-17(22)19-15(20)10-24-16(21)11-23-14-8-7-12-5-3-4-6-13(12)9-14/h3-9H,2,10-11H2,1H3,(H2,18,19,20,22).
What are the key properties of [2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate?
[2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate has a molecular weight of 330.34 g/mol, XLogP of 1.61, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate is sourced from PubChem (CID 2583176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).