1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone

C23H21NO2 — CID 7919443

IUPAC1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone
SMILESO=C(COc1ccccc1-c1ccccc1)N1CCCc2ccccc21
InChIInChI=1S/C23H21NO2/c25-23(24-16-8-12-19-11-4-6-14-21(19)24)17-26-22-15-7-5-13-20(22)18-9-2-1-3-10-18/h1-7,9-11,13-15H,8,12,16-17H2
InChIKeyHZBYNPIKVHXUAB-UHFFFAOYSA-N
MW343.43 g/mol
LogP4.71
Rot. Bonds4

About 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone

1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone (PubChem CID 7919443) has the molecular formula C23H21NO2 and a molecular weight of 343.43 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone
PubChem CID7919443
Molecular FormulaC23H21NO2
Molecular Weight343.43 g/mol
Exact Mass343.16
IUPAC Name1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone
SMILESO=C(COc1ccccc1-c1ccccc1)N1CCCc2ccccc21
InChIInChI=1S/C23H21NO2/c25-23(24-16-8-12-19-11-4-6-14-21(19)24)17-26-22-15-7-5-13-20(22)18-9-2-1-3-10-18/h1-7,9-11,13-15H,8,12,16-17H2
InChIKeyHZBYNPIKVHXUAB-UHFFFAOYSA-N
XLogP4.71
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dihydro-2H-quinolin-1-yl)-2-(4-phenylphenoxy)ethanone
CID 2788983
1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(2-phenylphenoxy)ethanone
CID 18189945
1-(3,4-dihydro-2H-quinolin-1-yl)-2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethoxy]ethanone
CID 2361983
2-(3,4-dihydro-2H-quinolin-1-yl)-N'-[2-(2-phenylphenoxy)acetyl]acetohydrazide
CID 4790915
2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethoxy]-4-methylbenzoic acid
CID 45418422
[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl] 2-(2-fluorophenoxy)acetate
CID 7842352
[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl] 2-(2-methylphenoxy)acetate
CID 7767831
2-(4-bromophenoxy)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone
CID 730148
2-(2-chlorophenoxy)-1-(2,3-dihydroindol-1-yl)ethanone
CID 823401
[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl] benzoate
CID 2361400
2-(2-tert-butyl-4-methylphenoxy)-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone
CID 3285362
5-bromo-2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethoxy]benzaldehyde
CID 7820189

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone?
The IUPAC name of 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone (CID 7919443) is 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone.
What is the SMILES notation for 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone?
The canonical SMILES for 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone is O=C(COc1ccccc1-c1ccccc1)N1CCCc2ccccc21.
What is the InChIKey of 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone?
The InChIKey is HZBYNPIKVHXUAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21NO2/c25-23(24-16-8-12-19-11-4-6-14-21(19)24)17-26-22-15-7-5-13-20(22)18-9-2-1-3-10-18/h1-7,9-11,13-15H,8,12,16-17H2.
What are the key properties of 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone?
1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone has a molecular weight of 343.43 g/mol, XLogP of 4.71, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(2-phenylphenoxy)ethanone is sourced from PubChem (CID 7919443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).