2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide

C19H22FNO2 — CID 69403433

IUPAC2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide
SMILESCOCCN(C)C(=O)C(C)c1ccc(-c2ccccc2)c(F)c1
InChIInChI=1S/C19H22FNO2/c1-14(19(22)21(2)11-12-23-3)16-9-10-17(18(20)13-16)15-7-5-4-6-8-15/h4-10,13-14H,11-12H2,1-3H3
InChIKeyWRAAJJCFTAFKLN-UHFFFAOYSA-N
MW315.39 g/mol
LogP3.70
Rot. Bonds6

About 2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide

2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide (PubChem CID 69403433) has the molecular formula C19H22FNO2 and a molecular weight of 315.39 g/mol. Its IUPAC name is 2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide.

Molecular Properties

Compound Name2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide
PubChem CID69403433
Molecular FormulaC19H22FNO2
Molecular Weight315.39 g/mol
Exact Mass315.16
IUPAC Name2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide
SMILESCOCCN(C)C(=O)C(C)c1ccc(-c2ccccc2)c(F)c1
InChIInChI=1S/C19H22FNO2/c1-14(19(22)21(2)11-12-23-3)16-9-10-17(18(20)13-16)15-7-5-4-6-8-15/h4-10,13-14H,11-12H2,1-3H3
InChIKeyWRAAJJCFTAFKLN-UHFFFAOYSA-N
XLogP3.70
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.39
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-aminopropyl 2-(3-fluoro-4-phenylphenyl)propanoate
CID 139513351
sodium;2-(3-fluoro-4-phenylphenyl)propanoic acid;hydride
CID 172995337
2-(2-methoxyethyldisulfanyl)ethyl 4-(3-fluoro-4-phenylphenyl)-3-oxopentanoate
CID 58493103
benzyl 2-(3-fluoro-4-phenylphenyl)propanoate
CID 16753995
sodium;carbonic acid;2-(3-fluoro-4-phenylphenyl)propanoic acid;hydride
CID 173161937
5-(3-fluoro-4-phenylphenyl)-4-oxohexanoic acid
CID 19785566
hexyl 2-(3-fluoro-4-phenylphenyl)propanoate
CID 171478067
(dibenzylamino) (2S)-2-(3-fluoro-4-phenylphenyl)propanoate
CID 87119000
4-bromobutyl 2-(3-fluoro-4-phenylphenyl)propanoate
CID 52936826
5-chloro-2-(3-fluoro-4-phenylphenyl)hexan-3-one
CID 143928439
(2S)-2-(3-fluoro-4-phenylphenyl)propanoate;[(1S)-1-phenylethyl]azanium
CID 139088547
(2R)-1-[3-(dimethylamino)cyclopentyl]-2-(3-fluoro-4-phenylphenyl)propan-1-one
CID 143527468

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide?
The IUPAC name of 2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide (CID 69403433) is 2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide.
What is the SMILES notation for 2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide?
The canonical SMILES for 2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide is COCCN(C)C(=O)C(C)c1ccc(-c2ccccc2)c(F)c1.
What is the InChIKey of 2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide?
The InChIKey is WRAAJJCFTAFKLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FNO2/c1-14(19(22)21(2)11-12-23-3)16-9-10-17(18(20)13-16)15-7-5-4-6-8-15/h4-10,13-14H,11-12H2,1-3H3.
What are the key properties of 2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide?
2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide has a molecular weight of 315.39 g/mol, XLogP of 3.70, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-4-phenylphenyl)-N-(2-methoxyethyl)-N-methylpropanamide is sourced from PubChem (CID 69403433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).