3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide

C19H22FNO2 — CID 95172563

IUPAC3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide
SMILESCOc1cccc(CCCNC(=O)CCc2ccccc2F)c1
InChIInChI=1S/C19H22FNO2/c1-23-17-9-4-6-15(14-17)7-5-13-21-19(22)12-11-16-8-2-3-10-18(16)20/h2-4,6,8-10,14H,5,7,11-13H2,1H3,(H,21,22)
InChIKeySRSWTYYOXFGMJF-UHFFFAOYSA-N
MW315.39 g/mol
LogP3.52
Rot. Bonds8

About 3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide

3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide (PubChem CID 95172563) has the molecular formula C19H22FNO2 and a molecular weight of 315.39 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide.

Molecular Properties

Compound Name3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide
PubChem CID95172563
Molecular FormulaC19H22FNO2
Molecular Weight315.39 g/mol
Exact Mass315.16
IUPAC Name3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide
SMILESCOc1cccc(CCCNC(=O)CCc2ccccc2F)c1
InChIInChI=1S/C19H22FNO2/c1-23-17-9-4-6-15(14-17)7-5-13-21-19(22)12-11-16-8-2-3-10-18(16)20/h2-4,6,8-10,14H,5,7,11-13H2,1H3,(H,21,22)
InChIKeySRSWTYYOXFGMJF-UHFFFAOYSA-N
XLogP3.52
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.39
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide
CID 127121905
N-[4-(2-fluorophenyl)butyl]-4-(3-methoxyphenyl)-4-oxobutanamide
CID 110607212
2-(4-methoxyphenoxy)-N-[3-(3-methoxyphenyl)propyl]acetamide
CID 95172596
N-[2-[acetyl-[2-(3-methoxyphenyl)ethyl]amino]ethyl]-2-(2-fluorophenyl)acetamide
CID 113055919
N-(4-methoxybutyl)-3-(3-methoxyphenyl)propanamide
CID 110418006
3-(3-methoxyphenyl)-N-[3-[(2,2,2-trifluoroacetyl)amino]propyl]propanamide
CID 108934905
3-[acetyl-[2-(3-methoxyphenyl)ethyl]amino]-N-[(2-fluorophenyl)methyl]propanamide
CID 113121357
N-[2-(3-methoxyphenyl)ethyl]-4-(methylamino)butanamide
CID 113266225
3-(2-fluorophenyl)-N-pentylpropanamide
CID 94133753
(2R)-2-(4-fluorophenoxy)-N-[3-(3-methoxyphenyl)propyl]propanamide
CID 95172603
2-(2,5-dimethylphenyl)-N-[3-(3-methoxyphenyl)propyl]acetamide
CID 38002281
2-(4-methoxyphenoxy)-N-[3-(3-methoxyphenyl)propyl]butanamide
CID 132653897

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide?
The IUPAC name of 3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide (CID 95172563) is 3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide.
What is the SMILES notation for 3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide?
The canonical SMILES for 3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide is COc1cccc(CCCNC(=O)CCc2ccccc2F)c1.
What is the InChIKey of 3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide?
The InChIKey is SRSWTYYOXFGMJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FNO2/c1-23-17-9-4-6-15(14-17)7-5-13-21-19(22)12-11-16-8-2-3-10-18(16)20/h2-4,6,8-10,14H,5,7,11-13H2,1H3,(H,21,22).
What are the key properties of 3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide?
3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide has a molecular weight of 315.39 g/mol, XLogP of 3.52, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide is sourced from PubChem (CID 95172563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).