3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide

C17H16F3NO3 — CID 17034567

IUPAC3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
SMILESCOc1ccccc1OCCC(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C17H16F3NO3/c1-23-14-8-4-5-9-15(14)24-11-10-16(22)21-13-7-3-2-6-12(13)17(18,19)20/h2-9H,10-11H2,1H3,(H,21,22)
InChIKeyQVPMALSOEQKQKT-UHFFFAOYSA-N
MW339.31 g/mol
LogP4.12
Rot. Bonds6

About 3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide

3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide (PubChem CID 17034567) has the molecular formula C17H16F3NO3 and a molecular weight of 339.31 g/mol. Its IUPAC name is 3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide.

Molecular Properties

Compound Name3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
PubChem CID17034567
Molecular FormulaC17H16F3NO3
Molecular Weight339.31 g/mol
Exact Mass339.11
IUPAC Name3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
SMILESCOc1ccccc1OCCC(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C17H16F3NO3/c1-23-14-8-4-5-9-15(14)24-11-10-16(22)21-13-7-3-2-6-12(13)17(18,19)20/h2-9H,10-11H2,1H3,(H,21,22)
InChIKeyQVPMALSOEQKQKT-UHFFFAOYSA-N
XLogP4.12
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.31
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(2-methoxyphenoxy)ethyl]-3-[2-(trifluoromethyl)phenyl]urea
CID 112971460
3-phenoxy-N-[2-(trifluoromethyl)phenyl]propanamide
CID 19168027
3-(2-methoxyphenoxy)-N-(2-methylsulfanylphenyl)propanamide
CID 78768134
2-[2-(2-methoxyethoxy)anilino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 47077742
N-[2-(ethylaminomethyl)phenyl]-3-(2-methoxyphenoxy)propanamide
CID 119439282
2-[ethyl-[2-(2-methoxyphenoxy)acetyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 7958698
3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 109039806
3-(4-chlorophenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 108789991
N-[2-(2-methoxyphenoxy)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 46546443
2-methoxy-N-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]benzamide
CID 5020852
3-[2-(4-methoxyphenoxy)ethylamino]-N-[2-(trifluoromethyl)phenyl]propanamide
CID 109031142
1-(2-tert-butylphenyl)-3-[2-(2-methoxyphenoxy)ethyl]urea
CID 112971443

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide?
The IUPAC name of 3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide (CID 17034567) is 3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide.
What is the SMILES notation for 3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide?
The canonical SMILES for 3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide is COc1ccccc1OCCC(=O)Nc1ccccc1C(F)(F)F.
What is the InChIKey of 3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide?
The InChIKey is QVPMALSOEQKQKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F3NO3/c1-23-14-8-4-5-9-15(14)24-11-10-16(22)21-13-7-3-2-6-12(13)17(18,19)20/h2-9H,10-11H2,1H3,(H,21,22).
What are the key properties of 3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide?
3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide has a molecular weight of 339.31 g/mol, XLogP of 4.12, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide is sourced from PubChem (CID 17034567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).