2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide

C14H16N2O2 — CID 43243362

IUPAC2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide
SMILESCCN(C(=O)COc1ccccc1C#N)C1CC1
InChIInChI=1S/C14H16N2O2/c1-2-16(12-7-8-12)14(17)10-18-13-6-4-3-5-11(13)9-15/h3-6,12H,2,7-8,10H2,1H3
InChIKeyYLTMDHDENUPARQ-UHFFFAOYSA-N
MW244.29 g/mol
LogP1.95
Rot. Bonds5

About 2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide

2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide (PubChem CID 43243362) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide.

Molecular Properties

Compound Name2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide
PubChem CID43243362
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide
SMILESCCN(C(=O)COc1ccccc1C#N)C1CC1
InChIInChI=1S/C14H16N2O2/c1-2-16(12-7-8-12)14(17)10-18-13-6-4-3-5-11(13)9-15/h3-6,12H,2,7-8,10H2,1H3
InChIKeyYLTMDHDENUPARQ-UHFFFAOYSA-N
XLogP1.95
TPSA53.33 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-(2-cyanophenoxy)acetyl]-cyclopropylamino]propanoic acid
CID 60844199
2-(5-chloro-2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide
CID 80708889
N-cyclopropyl-N-ethyl-2-[2-(hydroxymethyl)phenoxy]acetamide
CID 60772880
2-(2-cyanophenoxy)-N-hydroxy-N-methylacetamide
CID 20669597
2-(2-cyanophenoxy)-N-cyclopropyl-N-(1,1-dioxothiolan-3-yl)acetamide
CID 60602307
N-cyclopropyl-N-ethyl-2-[2-(ethylaminomethyl)phenoxy]acetamide
CID 61487903
3-[[2-(2-cyanophenoxy)acetyl]-ethylamino]-2-methylpropanoic acid
CID 62827727
2-[[2-(2-cyanophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide
CID 60665697
[2-[cyclopropyl(ethyl)amino]-2-oxoethyl] 2-(2-aminophenoxy)acetate
CID 61488778
2-(2-cyanophenoxy)-N-(3-ethoxycyclobutyl)acetamide
CID 102610563
2-[[2-(2-cyanophenoxy)acetyl]-methylamino]acetamide
CID 43374251
2-(2-cyclohexyl-2-oxoethoxy)benzonitrile
CID 113223270

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide?
The IUPAC name of 2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide (CID 43243362) is 2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide.
What is the SMILES notation for 2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide?
The canonical SMILES for 2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide is CCN(C(=O)COc1ccccc1C#N)C1CC1.
What is the InChIKey of 2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide?
The InChIKey is YLTMDHDENUPARQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-2-16(12-7-8-12)14(17)10-18-13-6-4-3-5-11(13)9-15/h3-6,12H,2,7-8,10H2,1H3.
What are the key properties of 2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide?
2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide has a molecular weight of 244.29 g/mol, XLogP of 1.95, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide is sourced from PubChem (CID 43243362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).