2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide

C11H15FN2O2 — CID 79464256

IUPAC2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide
SMILESCc1ccc(F)c(NC(=O)COCCN)c1
InChIInChI=1S/C11H15FN2O2/c1-8-2-3-9(12)10(6-8)14-11(15)7-16-5-4-13/h2-3,6H,4-5,7,13H2,1H3,(H,14,15)
InChIKeyNQVASBRCDZTHGN-UHFFFAOYSA-N
MW226.25 g/mol
LogP1.05
Rot. Bonds5

About 2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide

2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide (PubChem CID 79464256) has the molecular formula C11H15FN2O2 and a molecular weight of 226.25 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide
PubChem CID79464256
Molecular FormulaC11H15FN2O2
Molecular Weight226.25 g/mol
Exact Mass226.11
IUPAC Name2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide
SMILESCc1ccc(F)c(NC(=O)COCCN)c1
InChIInChI=1S/C11H15FN2O2/c1-8-2-3-9(12)10(6-8)14-11(15)7-16-5-4-13/h2-3,6H,4-5,7,13H2,1H3,(H,14,15)
InChIKeyNQVASBRCDZTHGN-UHFFFAOYSA-N
XLogP1.05
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.25
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-aminoethoxy)-N-(2-fluoro-4-methylphenyl)acetamide
CID 79463499
2-hydroxyethyl N-(2-fluoro-5-methylphenyl)carbamate
CID 79346664
2-(4-aminophenoxy)-N-(2-fluoro-5-methylphenyl)acetamide
CID 61094742
chloromethyl N-(2-fluoro-5-methylphenyl)carbamate
CID 164652670
2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide
CID 82817938
5-[[2-(2-aminoethoxy)acetyl]amino]-2,4-difluorobenzoic acid
CID 79472946
(3Z)-3-amino-N-(2-fluoro-5-methylphenyl)-3-hydroxyiminopropanamide
CID 43156189
N-(5-amino-2-fluorophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide
CID 64853622
4-(2-fluoro-5-methylanilino)-4-oxobutanoic acid
CID 6470807
N-(5-amino-2-fluorophenyl)-2-[3-(2-methoxyethoxy)propoxy]acetamide
CID 103401139
N-(2-fluoro-5-methylphenyl)-2-(2,3,4,5,6-pentafluorophenyl)acetamide
CID 17449540
N-(5-amino-2-fluorophenyl)-2-[2-(3-methoxypropoxy)ethoxy]acetamide
CID 103176942

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide?
The IUPAC name of 2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide (CID 79464256) is 2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide.
What is the SMILES notation for 2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide?
The canonical SMILES for 2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide is Cc1ccc(F)c(NC(=O)COCCN)c1.
What is the InChIKey of 2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide?
The InChIKey is NQVASBRCDZTHGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O2/c1-8-2-3-9(12)10(6-8)14-11(15)7-16-5-4-13/h2-3,6H,4-5,7,13H2,1H3,(H,14,15).
What are the key properties of 2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide?
2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide has a molecular weight of 226.25 g/mol, XLogP of 1.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide is sourced from PubChem (CID 79464256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).