N-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide

C20H24FNO3 — CID 78853259

IUPACN-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide
SMILESCCN(C(=O)C(C)Oc1cccc(F)c1)C(C)c1cccc(OC)c1
InChIInChI=1S/C20H24FNO3/c1-5-22(14(2)16-8-6-10-18(12-16)24-4)20(23)15(3)25-19-11-7-9-17(21)13-19/h6-15H,5H2,1-4H3
InChIKeyXYDFZPNNPFCUMW-UHFFFAOYSA-N
MW345.41 g/mol
LogP4.21
Rot. Bonds7

About N-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide

N-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide (PubChem CID 78853259) has the molecular formula C20H24FNO3 and a molecular weight of 345.41 g/mol. Its IUPAC name is N-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide.

Molecular Properties

Compound NameN-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide
PubChem CID78853259
Molecular FormulaC20H24FNO3
Molecular Weight345.41 g/mol
Exact Mass345.17
IUPAC NameN-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide
SMILESCCN(C(=O)C(C)Oc1cccc(F)c1)C(C)c1cccc(OC)c1
InChIInChI=1S/C20H24FNO3/c1-5-22(14(2)16-8-6-10-18(12-16)24-4)20(23)15(3)25-19-11-7-9-17(21)13-19/h6-15H,5H2,1-4H3
InChIKeyXYDFZPNNPFCUMW-UHFFFAOYSA-N
XLogP4.21
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.41
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2,4-difluoro-N-[1-(3-methoxyphenyl)ethyl]benzamide
CID 75807721
2-amino-N-ethyl-N-[1-(3-methoxyphenyl)ethyl]acetamide;hydrochloride
CID 119295043
N,N-diethyl-2-(3-methoxyphenoxy)propanamide
CID 19203980
N-ethyl-N-[1-(3-hydroxyphenyl)ethyl]-2-methoxypropanamide
CID 112696419
N-ethyl-3-iodo-N-[1-(3-methoxyphenyl)ethyl]benzamide
CID 55593336
cis-(1S,2R)-2-[ethyl-[(1R)-1-(3-methoxyphenyl)ethyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 125131878
N-ethyl-N-[(1R)-1-(3-methoxyphenyl)ethyl]oxane-4-carboxamide
CID 52574182
3-[[ethyl-[1-(3-methoxyphenyl)ethyl]carbamoyl]amino]propanoic acid
CID 122019316
N-ethyl-N-[1-(3-methoxyphenyl)ethyl]-2,5-dimethylbenzamide
CID 55591908
1-ethyl-1-[1-(4-fluorophenyl)ethyl]-3-[(3-methoxyphenyl)methyl]urea
CID 87037661
1-ethyl-1-[1-(3-methoxyphenyl)ethyl]-3-[[4-(trifluoromethyl)phenyl]methyl]urea
CID 78886119
2-[2-(3-fluorophenoxy)propanoyl-methylamino]propanoic acid
CID 62626189

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide?
The IUPAC name of N-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide (CID 78853259) is N-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide.
What is the SMILES notation for N-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide?
The canonical SMILES for N-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide is CCN(C(=O)C(C)Oc1cccc(F)c1)C(C)c1cccc(OC)c1.
What is the InChIKey of N-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide?
The InChIKey is XYDFZPNNPFCUMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FNO3/c1-5-22(14(2)16-8-6-10-18(12-16)24-4)20(23)15(3)25-19-11-7-9-17(21)13-19/h6-15H,5H2,1-4H3.
What are the key properties of N-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide?
N-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide has a molecular weight of 345.41 g/mol, XLogP of 4.21, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-fluorophenoxy)-N-[1-(3-methoxyphenyl)ethyl]propanamide is sourced from PubChem (CID 78853259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).