N-(2-aminoethyl)-N-(4-fluorophenyl)acetamide

C10H13FN2O — CID 28769229

IUPACN-(2-aminoethyl)-N-(4-fluorophenyl)acetamide
SMILESCC(=O)N(CCN)c1ccc(F)cc1
InChIInChI=1S/C10H13FN2O/c1-8(14)13(7-6-12)10-4-2-9(11)3-5-10/h2-5H,6-7,12H2,1H3
InChIKeyMGAKMOGJHRFXTK-UHFFFAOYSA-N
MW196.23 g/mol
LogP1.14
Rot. Bonds3

About N-(2-aminoethyl)-N-(4-fluorophenyl)acetamide

N-(2-aminoethyl)-N-(4-fluorophenyl)acetamide (PubChem CID 28769229) has the molecular formula C10H13FN2O and a molecular weight of 196.23 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-(4-fluorophenyl)acetamide
PubChem CID28769229
Molecular FormulaC10H13FN2O
Molecular Weight196.23 g/mol
Exact Mass196.10
IUPAC NameN-(2-aminoethyl)-N-(4-fluorophenyl)acetamide
SMILESCC(=O)N(CCN)c1ccc(F)cc1
InChIInChI=1S/C10H13FN2O/c1-8(14)13(7-6-12)10-4-2-9(11)3-5-10/h2-5H,6-7,12H2,1H3
InChIKeyMGAKMOGJHRFXTK-UHFFFAOYSA-N
XLogP1.14
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.23
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-aminopropyl)-N-(4-fluorophenyl)acetamide
CID 28767388
N-[2-(N-acetyl-4-fluoroanilino)ethyl]acetamide
CID 113059276
N-(2-aminoethyl)-N-(4-fluorophenyl)-4-methylbenzamide
CID 28769273
N-(2-aminoethyl)-2-fluoro-N-(4-fluorophenyl)benzamide
CID 28769276
1-(2-aminoethyl)-1-(4-fluorophenyl)-3-(4-methylphenyl)urea
CID 770559
methyl N-[2-(N-acetyl-4-fluoroanilino)ethyl]carbamate
CID 113059341
N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide
CID 113059351
N-(2-aminoethyl)-3-fluoro-N-(4-fluorophenyl)benzamide
CID 28769279
1-(3-aminopropyl)-1-(4-fluorophenyl)urea
CID 43136215
N-[2-(N-acetyl-4-fluoroanilino)ethyl]-2,2-dimethylpropanamide
CID 113059285
N-(2-aminoethyl)-N-(3,4-dimethoxyphenyl)acetamide
CID 28769902
N-[2-(N-acetyl-4-fluoroanilino)ethyl]-2-(2-fluorophenyl)acetamide
CID 113059334

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-(4-fluorophenyl)acetamide?
The IUPAC name of N-(2-aminoethyl)-N-(4-fluorophenyl)acetamide (CID 28769229) is N-(2-aminoethyl)-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-(2-aminoethyl)-N-(4-fluorophenyl)acetamide?
The canonical SMILES for N-(2-aminoethyl)-N-(4-fluorophenyl)acetamide is CC(=O)N(CCN)c1ccc(F)cc1.
What is the InChIKey of N-(2-aminoethyl)-N-(4-fluorophenyl)acetamide?
The InChIKey is MGAKMOGJHRFXTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O/c1-8(14)13(7-6-12)10-4-2-9(11)3-5-10/h2-5H,6-7,12H2,1H3.
What are the key properties of N-(2-aminoethyl)-N-(4-fluorophenyl)acetamide?
N-(2-aminoethyl)-N-(4-fluorophenyl)acetamide has a molecular weight of 196.23 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 28769229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).