N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide

C18H19FN2O3 — CID 86929205

IUPACN-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide
SMILESCC(C)(Oc1ccc(F)cc1)C(=O)Nc1ccccc1CC(N)=O
InChIInChI=1S/C18H19FN2O3/c1-18(2,24-14-9-7-13(19)8-10-14)17(23)21-15-6-4-3-5-12(15)11-16(20)22/h3-10H,11H2,1-2H3,(H2,20,22)(H,21,23)
InChIKeyQVEOGWVWCPEQCU-UHFFFAOYSA-N
MW330.36 g/mol
LogP2.65
Rot. Bonds6

About N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide

N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide (PubChem CID 86929205) has the molecular formula C18H19FN2O3 and a molecular weight of 330.36 g/mol. Its IUPAC name is N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide.

Molecular Properties

Compound NameN-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide
PubChem CID86929205
Molecular FormulaC18H19FN2O3
Molecular Weight330.36 g/mol
Exact Mass330.14
IUPAC NameN-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide
SMILESCC(C)(Oc1ccc(F)cc1)C(=O)Nc1ccccc1CC(N)=O
InChIInChI=1S/C18H19FN2O3/c1-18(2,24-14-9-7-13(19)8-10-14)17(23)21-15-6-4-3-5-12(15)11-16(20)22/h3-10H,11H2,1-2H3,(H2,20,22)(H,21,23)
InChIKeyQVEOGWVWCPEQCU-UHFFFAOYSA-N
XLogP2.65
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.36
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-fluorophenoxy)-N-(2-hydroxyphenyl)-2-methylpropanamide
CID 86978390
2-(4-bromophenoxy)-N-(2-ethylphenyl)-2-methylpropanamide
CID 17162562
N-[2-(2-amino-2-oxoethyl)phenyl]-2-bromo-2-methylpropanamide
CID 114327737
2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide
CID 86982882
N-(2,4-difluorophenyl)-2-(4-fluorophenoxy)-2-methylpropanamide
CID 30854578
2-(4-fluorophenoxy)-2-methylpropanehydrazide
CID 43236623
2-[2-[(4-fluorophenyl)carbamoylamino]phenyl]acetamide
CID 90271537
2-(aminomethyl)-N-[2-(2-amino-2-oxoethyl)phenyl]-2-ethylbutanamide
CID 115431675
2-(4-chlorophenoxy)-2-methyl-N-[2-(trifluoromethyl)phenyl]propanamide
CID 5085201
N-[2-(2-amino-2-oxoethyl)phenyl]-2,2,3,3-tetrafluoropropanamide
CID 103732853
N-(2-bromophenyl)-2-methyl-2-phenoxypropanamide
CID 17173105
2-(4-chlorophenoxy)-2-methyl-N-(2-methylphenyl)propanamide
CID 2184934

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide?
The IUPAC name of N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide (CID 86929205) is N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide.
What is the SMILES notation for N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide?
The canonical SMILES for N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide is CC(C)(Oc1ccc(F)cc1)C(=O)Nc1ccccc1CC(N)=O.
What is the InChIKey of N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide?
The InChIKey is QVEOGWVWCPEQCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O3/c1-18(2,24-14-9-7-13(19)8-10-14)17(23)21-15-6-4-3-5-12(15)11-16(20)22/h3-10H,11H2,1-2H3,(H2,20,22)(H,21,23).
What are the key properties of N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide?
N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide has a molecular weight of 330.36 g/mol, XLogP of 2.65, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide is sourced from PubChem (CID 86929205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).