N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide

C16H15ClFNO3 — CID 3318555

IUPACN-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide
SMILESCOc1ccc(Cl)cc1NC(=O)C(C)Oc1ccccc1F
InChIInChI=1S/C16H15ClFNO3/c1-10(22-14-6-4-3-5-12(14)18)16(20)19-13-9-11(17)7-8-15(13)21-2/h3-10H,1-2H3,(H,19,20)
InChIKeyFNEXUROUQNXPBY-UHFFFAOYSA-N
MW323.75 g/mol
LogP3.89
Rot. Bonds5

About N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide

N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide (PubChem CID 3318555) has the molecular formula C16H15ClFNO3 and a molecular weight of 323.75 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide
PubChem CID3318555
Molecular FormulaC16H15ClFNO3
Molecular Weight323.75 g/mol
Exact Mass323.07
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide
SMILESCOc1ccc(Cl)cc1NC(=O)C(C)Oc1ccccc1F
InChIInChI=1S/C16H15ClFNO3/c1-10(22-14-6-4-3-5-12(14)18)16(20)19-13-9-11(17)7-8-15(13)21-2/h3-10H,1-2H3,(H,19,20)
InChIKeyFNEXUROUQNXPBY-UHFFFAOYSA-N
XLogP3.89
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.75
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-fluorophenoxy)propanamide
CID 31966341
(2R)-N-(2,4-dichlorophenyl)-2-(2-fluorophenoxy)propanamide
CID 7815023
(2R)-N-(5-chloro-2-methoxyphenyl)-2-(4-chloro-2-methylphenoxy)propanamide
CID 1222422
(2R)-N-(5-chloro-2-methoxyphenyl)-2-(3-fluorophenoxy)propanamide
CID 7834540
(2S)-2-(3-acetamidophenoxy)-N-(5-chloro-2-methoxyphenyl)propanamide
CID 7698294
N-(2,5-difluorophenyl)-2-(2-fluorophenoxy)propanamide
CID 86909512
(2S)-N-(5-chloro-2-methoxyphenyl)-2-(5-fluoro-2-nitrophenoxy)propanamide
CID 2631758
1-[[(2R)-2-(2-fluorophenoxy)propanoyl]amino]-3-(2-methoxyphenyl)urea
CID 51980854
(2S)-N-(3-chlorophenyl)-2-(2-fluorophenoxy)propanamide
CID 887599
(2R)-2-(2,4-dichlorophenoxy)-N-(2-fluorophenyl)propanamide
CID 881150
[(2R)-1-(5-chloro-2-methoxyanilino)-1-oxopropan-2-yl] 2-methoxybenzoate
CID 2506054
(2S)-N'-[2-(5-chloro-2-methoxyphenyl)acetyl]-2-(2-fluorophenoxy)propanehydrazide
CID 9087471

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide (CID 3318555) is N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide is COc1ccc(Cl)cc1NC(=O)C(C)Oc1ccccc1F.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide?
The InChIKey is FNEXUROUQNXPBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClFNO3/c1-10(22-14-6-4-3-5-12(14)18)16(20)19-13-9-11(17)7-8-15(13)21-2/h3-10H,1-2H3,(H,19,20).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide?
N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide has a molecular weight of 323.75 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)propanamide is sourced from PubChem (CID 3318555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).