2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone

C20H24FNO2 — CID 82052145

IUPAC2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone
SMILESCCN(CC)CC(=O)c1cc(C)ccc1OCc1ccccc1F
InChIInChI=1S/C20H24FNO2/c1-4-22(5-2)13-19(23)17-12-15(3)10-11-20(17)24-14-16-8-6-7-9-18(16)21/h6-12H,4-5,13-14H2,1-3H3
InChIKeyJOYZGWGMBMRHFG-UHFFFAOYSA-N
MW329.42 g/mol
LogP4.24
Rot. Bonds8

About 2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone

2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone (PubChem CID 82052145) has the molecular formula C20H24FNO2 and a molecular weight of 329.42 g/mol. Its IUPAC name is 2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone.

Molecular Properties

Compound Name2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone
PubChem CID82052145
Molecular FormulaC20H24FNO2
Molecular Weight329.42 g/mol
Exact Mass329.18
IUPAC Name2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone
SMILESCCN(CC)CC(=O)c1cc(C)ccc1OCc1ccccc1F
InChIInChI=1S/C20H24FNO2/c1-4-22(5-2)13-19(23)17-12-15(3)10-11-20(17)24-14-16-8-6-7-9-18(16)21/h6-12H,4-5,13-14H2,1-3H3
InChIKeyJOYZGWGMBMRHFG-UHFFFAOYSA-N
XLogP4.24
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.42
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-fluorophenyl)methoxy]-5-methylaniline
CID 39247930
(1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol
CID 78934333
2-[(2-fluorophenoxy)methyl]-5-methylbenzoic acid
CID 117221035
5-methyl-2-[(2-methylphenyl)methoxy]benzoic acid
CID 25109956
1-[2-[(2,4-difluorophenyl)methoxy]-5-methylphenyl]-4-methylpent-4-en-1-one
CID 142835435
2-[(2-fluorophenyl)methoxy]benzoic acid
CID 8707038
1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63326290
1-(2,5-dimethylphenyl)-2-(2-fluorophenyl)ethanone
CID 43337245
1-(2,4-dimethylphenyl)-2-[(2-fluorophenyl)methoxy]ethanone
CID 63936552
N-ethyl-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanamine
CID 43505172
4-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]but-3-yn-1-ol
CID 60800079
(NZ)-N-[1-[2-[(2-chloro-3-fluorophenyl)methoxy]-5-methylphenyl]ethylidene]hydroxylamine
CID 115982997

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone?
The IUPAC name of 2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone (CID 82052145) is 2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone.
What is the SMILES notation for 2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone?
The canonical SMILES for 2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone is CCN(CC)CC(=O)c1cc(C)ccc1OCc1ccccc1F.
What is the InChIKey of 2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone?
The InChIKey is JOYZGWGMBMRHFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FNO2/c1-4-22(5-2)13-19(23)17-12-15(3)10-11-20(17)24-14-16-8-6-7-9-18(16)21/h6-12H,4-5,13-14H2,1-3H3.
What are the key properties of 2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone?
2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone has a molecular weight of 329.42 g/mol, XLogP of 4.24, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanone is sourced from PubChem (CID 82052145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).