N-(2-aminoethyl)-N-phenoxyacetamide

C10H14N2O2 — CID 140502076

IUPACN-(2-aminoethyl)-N-phenoxyacetamide
SMILESCC(=O)N(CCN)Oc1ccccc1
InChIInChI=1S/C10H14N2O2/c1-9(13)12(8-7-11)14-10-5-3-2-4-6-10/h2-6H,7-8,11H2,1H3
InChIKeyYRYWWXMYWMQDHC-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.79
Rot. Bonds4

About N-(2-aminoethyl)-N-phenoxyacetamide

N-(2-aminoethyl)-N-phenoxyacetamide (PubChem CID 140502076) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-phenoxyacetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-phenoxyacetamide
PubChem CID140502076
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC NameN-(2-aminoethyl)-N-phenoxyacetamide
SMILESCC(=O)N(CCN)Oc1ccccc1
InChIInChI=1S/C10H14N2O2/c1-9(13)12(8-7-11)14-10-5-3-2-4-6-10/h2-6H,7-8,11H2,1H3
InChIKeyYRYWWXMYWMQDHC-UHFFFAOYSA-N
XLogP0.79
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

sodium;[acetyl(phenoxy)amino]methyl-hydroxy-oxophosphanium;hydride
CID 175412657
ethyl(phenoxy)carbamic acid
CID 87330615
propan-2-yl N-[4-[2-[acetyl(phenoxy)amino]ethyl]phenyl]sulfonylcarbamate
CID 88808204
[acetyl(butyl)amino] benzoate
CID 152981173
N-methyl-N-(3-phenoxypropyl)acetamide
CID 60757278
N-(2-aminoethyl)-N-methylbenzamide
CID 28707416
N-(2-aminoethyl)-N-(benzylcarbamoyl)acetamide
CID 108871331
[acetyl(benzyl)amino] acetate
CID 131850460
phenyl 3-aminopropanoate;hydrochloride
CID 67243612
phenyl N-(3-aminopropyl)-N-propan-2-ylcarbamate
CID 43137069
N'-acetyl-N'-(2-aminoethyl)-N-benzyl-N-methyloxamide
CID 108518840
3-amino-N-methyl-N-(3-phenoxypropyl)propanamide;hydrochloride
CID 119294025

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-phenoxyacetamide?
The IUPAC name of N-(2-aminoethyl)-N-phenoxyacetamide (CID 140502076) is N-(2-aminoethyl)-N-phenoxyacetamide.
What is the SMILES notation for N-(2-aminoethyl)-N-phenoxyacetamide?
The canonical SMILES for N-(2-aminoethyl)-N-phenoxyacetamide is CC(=O)N(CCN)Oc1ccccc1.
What is the InChIKey of N-(2-aminoethyl)-N-phenoxyacetamide?
The InChIKey is YRYWWXMYWMQDHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-9(13)12(8-7-11)14-10-5-3-2-4-6-10/h2-6H,7-8,11H2,1H3.
What are the key properties of N-(2-aminoethyl)-N-phenoxyacetamide?
N-(2-aminoethyl)-N-phenoxyacetamide has a molecular weight of 194.23 g/mol, XLogP of 0.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-phenoxyacetamide is sourced from PubChem (CID 140502076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).