N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide

C18H20FNO2 — CID 90622906

IUPACN-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide
SMILESCOC(CNC(=O)CCc1ccccc1)c1cccc(F)c1
InChIInChI=1S/C18H20FNO2/c1-22-17(15-8-5-9-16(19)12-15)13-20-18(21)11-10-14-6-3-2-4-7-14/h2-9,12,17H,10-11,13H2,1H3,(H,20,21)
InChIKeyCXNKMIFIZYZETN-UHFFFAOYSA-N
MW301.36 g/mol
LogP3.26
Rot. Bonds7

About N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide

N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide (PubChem CID 90622906) has the molecular formula C18H20FNO2 and a molecular weight of 301.36 g/mol. Its IUPAC name is N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide
PubChem CID90622906
Molecular FormulaC18H20FNO2
Molecular Weight301.36 g/mol
Exact Mass301.15
IUPAC NameN-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide
SMILESCOC(CNC(=O)CCc1ccccc1)c1cccc(F)c1
InChIInChI=1S/C18H20FNO2/c1-22-17(15-8-5-9-16(19)12-15)13-20-18(21)11-10-14-6-3-2-4-7-14/h2-9,12,17H,10-11,13H2,1H3,(H,20,21)
InChIKeyCXNKMIFIZYZETN-UHFFFAOYSA-N
XLogP3.26
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.36
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide
CID 90623282
1-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylurea
CID 90623219
N-[2-(3-fluorophenyl)-2-methoxyethyl]-2-methylpropanamide
CID 90622872
2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide
CID 90622981
N-[2-(3-fluorophenyl)-2-methoxyethyl]-2-(4-propan-2-ylphenoxy)acetamide
CID 90622980
N'-[2-(3-fluorophenyl)-2-methoxyethyl]-N-(2-methoxyethyl)oxamide
CID 90623137
N-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide
CID 95777310
3-(4-fluorophenyl)-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]propanamide
CID 110663372
1-[(4-chlorophenyl)methyl]-3-[2-(3-fluorophenyl)-2-methoxyethyl]urea
CID 90623238
N-[(2S)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide
CID 95777311
N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide
CID 93032888
1-[2-(3-fluorophenyl)-2-methoxyethyl]-3-(4-methylphenyl)urea
CID 90623223

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide?
The IUPAC name of N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide (CID 90622906) is N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide.
What is the SMILES notation for N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide?
The canonical SMILES for N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide is COC(CNC(=O)CCc1ccccc1)c1cccc(F)c1.
What is the InChIKey of N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide?
The InChIKey is CXNKMIFIZYZETN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO2/c1-22-17(15-8-5-9-16(19)12-15)13-20-18(21)11-10-14-6-3-2-4-7-14/h2-9,12,17H,10-11,13H2,1H3,(H,20,21).
What are the key properties of N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide?
N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide has a molecular weight of 301.36 g/mol, XLogP of 3.26, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide is sourced from PubChem (CID 90622906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).