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

C23H21NO — CID 82051050

IUPAC2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone
SMILESO=C(CN1CCCc2ccccc21)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H21NO/c25-23(17-24-16-6-10-20-9-4-5-11-22(20)24)21-14-12-19(13-15-21)18-7-2-1-3-8-18/h1-5,7-9,11-15H,6,10,16-17H2
InChIKeyRDRBDVYZGZYQNF-UHFFFAOYSA-N
MW327.43 g/mol
LogP4.99
Rot. Bonds4

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

2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone (PubChem CID 82051050) has the molecular formula C23H21NO and a molecular weight of 327.43 g/mol. Its IUPAC name is 2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone.

Molecular Properties

Compound Name2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone
PubChem CID82051050
Molecular FormulaC23H21NO
Molecular Weight327.43 g/mol
Exact Mass327.16
IUPAC Name2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone
SMILESO=C(CN1CCCc2ccccc21)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H21NO/c25-23(17-24-16-6-10-20-9-4-5-11-22(20)24)21-14-12-19(13-15-21)18-7-2-1-3-8-18/h1-5,7-9,11-15H,6,10,16-17H2
InChIKeyRDRBDVYZGZYQNF-UHFFFAOYSA-N
XLogP4.99
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-ethoxyphenyl)ethanone
CID 82050319
2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)acetic acid
CID 54483331
4-[[2-(3,4-dihydro-2H-quinolin-1-yl)acetyl]amino]benzoic acid
CID 28866702
2-(3,4,5,6-tetrahydro-2H-1-benzazocin-1-yl)acetic acid
CID 119994270
2-(3,4-dihydro-2H-quinolin-1-yl)-1-(3-methoxyphenyl)ethanone
CID 43227216
2-(3,4-dihydro-2H-quinolin-1-yl)-1-(5-methylthiophen-2-yl)ethanone
CID 43227229
2-(3,4-dihydro-2H-quinolin-1-yl)acetohydrazide
CID 2327118
fluoro 2-(3,4-dihydro-2H-quinolin-1-yl)acetate
CID 145056467
(E)-4-(3,4-dihydro-2H-quinolin-1-yl)-3-methylbut-2-enoic acid
CID 55236328
(4-phenylphenyl)-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone
CID 67839485
N'-[2-(3,4-dihydro-2H-quinolin-1-yl)acetyl]-2-phenylacetohydrazide
CID 7923496
1-(3,4-dihydro-2H-quinolin-1-yl)-3-methoxypropan-2-one
CID 107507115

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone?
The IUPAC name of 2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone (CID 82051050) is 2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone.
What is the SMILES notation for 2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone?
The canonical SMILES for 2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone is O=C(CN1CCCc2ccccc21)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone?
The InChIKey is RDRBDVYZGZYQNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21NO/c25-23(17-24-16-6-10-20-9-4-5-11-22(20)24)21-14-12-19(13-15-21)18-7-2-1-3-8-18/h1-5,7-9,11-15H,6,10,16-17H2.
What are the key properties of 2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone?
2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone has a molecular weight of 327.43 g/mol, XLogP of 4.99, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-phenylphenyl)ethanone is sourced from PubChem (CID 82051050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).