1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone

C27H19NO — CID 135034335

IUPAC1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone
SMILESO=C(Cc1cc(-c2ccccc2)nc2ccccc12)c1ccc2ccccc2c1
InChIInChI=1S/C27H19NO/c29-27(22-15-14-19-8-4-5-11-21(19)16-22)18-23-17-26(20-9-2-1-3-10-20)28-25-13-7-6-12-24(23)25/h1-17H,18H2
InChIKeyKPDGLUYFWPXWNC-UHFFFAOYSA-N
MW373.46 g/mol
LogP6.48
Rot. Bonds4

About 1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone

1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone (PubChem CID 135034335) has the molecular formula C27H19NO and a molecular weight of 373.46 g/mol. Its IUPAC name is 1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone.

Molecular Properties

Compound Name1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone
PubChem CID135034335
Molecular FormulaC27H19NO
Molecular Weight373.46 g/mol
Exact Mass373.15
IUPAC Name1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone
SMILESO=C(Cc1cc(-c2ccccc2)nc2ccccc12)c1ccc2ccccc2c1
InChIInChI=1S/C27H19NO/c29-27(22-15-14-19-8-4-5-11-21(19)16-22)18-23-17-26(20-9-2-1-3-10-20)28-25-13-7-6-12-24(23)25/h1-17H,18H2
InChIKeyKPDGLUYFWPXWNC-UHFFFAOYSA-N
XLogP6.48
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.46
LogP ≤ 56.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone
CID 135034333
4-QUINOLINECARBOXYLIC ACID, 2-PHENYL-, SODIUM SALT (1:1)
CID 167996008
[2-(6-methoxynaphthalen-2-yl)-2-oxoethyl] 2-phenylquinoline-4-carboxylate
CID 23937440
1,4-dinaphthalen-2-ylbutane-1,4-dione
CID 593323
1-naphthalen-2-yl-2-(2-phenylcyclohexen-1-yl)ethanone
CID 132573010
europium;2-phenylquinoline-4-carboxylic acid
CID 87730786
deuterio-(2-phenylquinolin-4-yl)methanol
CID 88591215
2-(4-carboxyphenyl)quinoline-4-carboxylic acid
CID 57126411
bis(cyclopentane);bis(2-phenylquinoline-4-carboxylic acid);titanium(2+)
CID 135850214
[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] 2-phenylquinoline-4-carboxylate
CID 7866840
(2-phenylquinolin-4-yl)methanamine;hydrochloride
CID 82025622
2-(4-methyl-1,3-thiazol-2-yl)-1-naphthalen-2-ylethanone
CID 60976974

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone?
The IUPAC name of 1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone (CID 135034335) is 1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone.
What is the SMILES notation for 1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone?
The canonical SMILES for 1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone is O=C(Cc1cc(-c2ccccc2)nc2ccccc12)c1ccc2ccccc2c1.
What is the InChIKey of 1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone?
The InChIKey is KPDGLUYFWPXWNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H19NO/c29-27(22-15-14-19-8-4-5-11-21(19)16-22)18-23-17-26(20-9-2-1-3-10-20)28-25-13-7-6-12-24(23)25/h1-17H,18H2.
What are the key properties of 1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone?
1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone has a molecular weight of 373.46 g/mol, XLogP of 6.48, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone is sourced from PubChem (CID 135034335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).