3-naphthalen-2-yl-1-phenyl-3H-indol-2-one

C24H17NO — CID 118938995

IUPAC3-naphthalen-2-yl-1-phenyl-3H-indol-2-one
SMILESO=C1C(c2ccc3ccccc3c2)c2ccccc2N1c1ccccc1
InChIInChI=1S/C24H17NO/c26-24-23(19-15-14-17-8-4-5-9-18(17)16-19)21-12-6-7-13-22(21)25(24)20-10-2-1-3-11-20/h1-16,23H
InChIKeyPBDVCFHBWKPQIO-UHFFFAOYSA-N
MW335.41 g/mol
LogP5.65
Rot. Bonds2

About 3-naphthalen-2-yl-1-phenyl-3H-indol-2-one

3-naphthalen-2-yl-1-phenyl-3H-indol-2-one (PubChem CID 118938995) has the molecular formula C24H17NO and a molecular weight of 335.41 g/mol. Its IUPAC name is 3-naphthalen-2-yl-1-phenyl-3H-indol-2-one.

Molecular Properties

Compound Name3-naphthalen-2-yl-1-phenyl-3H-indol-2-one
PubChem CID118938995
Molecular FormulaC24H17NO
Molecular Weight335.41 g/mol
Exact Mass335.13
IUPAC Name3-naphthalen-2-yl-1-phenyl-3H-indol-2-one
SMILESO=C1C(c2ccc3ccccc3c2)c2ccccc2N1c1ccccc1
InChIInChI=1S/C24H17NO/c26-24-23(19-15-14-17-8-4-5-9-18(17)16-19)21-12-6-7-13-22(21)25(24)20-10-2-1-3-11-20/h1-16,23H
InChIKeyPBDVCFHBWKPQIO-UHFFFAOYSA-N
XLogP5.65
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.41
LogP ≤ 55.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-1-Naphthylphthalimide
CID 79252
3-(4-Dimethylaminonaphthalen-1-ylmethylene)-1,3-dihydroindol-2-one
CID 24906291
3-(4-Dimethylamino-naphthalen-1-ylmethylene)-1,3-dihydro-indol-2-one
CID 9839842
1-(5-(4-phenylpiperazin-1-yl)pentyl)benzo[cd]indol-2(1H)-one
CID 9843889
17-Phenyl-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione (non-preferred name)
CID 3094929
4-(1-Naphthyl)-4-azatetracyclo[5.3.2.0~2,6~.0~8,10~]dodec-11-ene-3,5-dione
CID 2860655
2-(2-ethylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
CID 2872879
2-(2-(2-phenylethyl)phenyl)-2,3-dihydro-1H-isoindole-1,3-dione
CID 10616182
1-[1-(2,3,3a,4,5,6-hexahydro-1H-phenalen-1-yl)piperidin-4-yl]-3H-indol-2-one
CID 49843739
(2,3-Dihydro-indol-1-yl)-naphthalen-2-yl-methanone
CID 3101356
1-(4-Fluorobenzyl)benzo[cd]indol-2(1H)-one
CID 573349
1-(4-Biphenylyl)benz[cd]indol-2(1H)-one
CID 629397

Frequently Asked Questions

What is the IUPAC name of 3-naphthalen-2-yl-1-phenyl-3H-indol-2-one?
The IUPAC name of 3-naphthalen-2-yl-1-phenyl-3H-indol-2-one (CID 118938995) is 3-naphthalen-2-yl-1-phenyl-3H-indol-2-one.
What is the SMILES notation for 3-naphthalen-2-yl-1-phenyl-3H-indol-2-one?
The canonical SMILES for 3-naphthalen-2-yl-1-phenyl-3H-indol-2-one is O=C1C(c2ccc3ccccc3c2)c2ccccc2N1c1ccccc1.
What is the InChIKey of 3-naphthalen-2-yl-1-phenyl-3H-indol-2-one?
The InChIKey is PBDVCFHBWKPQIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17NO/c26-24-23(19-15-14-17-8-4-5-9-18(17)16-19)21-12-6-7-13-22(21)25(24)20-10-2-1-3-11-20/h1-16,23H.
What are the key properties of 3-naphthalen-2-yl-1-phenyl-3H-indol-2-one?
3-naphthalen-2-yl-1-phenyl-3H-indol-2-one has a molecular weight of 335.41 g/mol, XLogP of 5.65, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-naphthalen-2-yl-1-phenyl-3H-indol-2-one is sourced from PubChem (CID 118938995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).