10-naphthalen-1-yl-1H-anthracen-2-one

C24H16O — CID 151365518

IUPAC10-naphthalen-1-yl-1H-anthracen-2-one
SMILESO=C1C=Cc2c(cc3ccccc3c2-c2cccc3ccccc23)C1
InChIInChI=1S/C24H16O/c25-19-12-13-22-18(15-19)14-17-7-2-4-10-21(17)24(22)23-11-5-8-16-6-1-3-9-20(16)23/h1-14H,15H2
InChIKeyOPIQCRSTAMOJMT-UHFFFAOYSA-N
MW320.39 g/mol
LogP5.80
Rot. Bonds1

About 10-naphthalen-1-yl-1H-anthracen-2-one

10-naphthalen-1-yl-1H-anthracen-2-one (PubChem CID 151365518) has the molecular formula C24H16O and a molecular weight of 320.39 g/mol. Its IUPAC name is 10-naphthalen-1-yl-1H-anthracen-2-one.

Molecular Properties

Compound Name10-naphthalen-1-yl-1H-anthracen-2-one
PubChem CID151365518
Molecular FormulaC24H16O
Molecular Weight320.39 g/mol
Exact Mass320.12
IUPAC Name10-naphthalen-1-yl-1H-anthracen-2-one
SMILESO=C1C=Cc2c(cc3ccccc3c2-c2cccc3ccccc23)C1
InChIInChI=1S/C24H16O/c25-19-12-13-22-18(15-19)14-17-7-2-4-10-21(17)24(22)23-11-5-8-16-6-1-3-9-20(16)23/h1-14H,15H2
InChIKeyOPIQCRSTAMOJMT-UHFFFAOYSA-N
XLogP5.80
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.39
LogP ≤ 55.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 10-naphthalen-1-yl-1H-anthracen-2-one?
The IUPAC name of 10-naphthalen-1-yl-1H-anthracen-2-one (CID 151365518) is 10-naphthalen-1-yl-1H-anthracen-2-one.
What is the SMILES notation for 10-naphthalen-1-yl-1H-anthracen-2-one?
The canonical SMILES for 10-naphthalen-1-yl-1H-anthracen-2-one is O=C1C=Cc2c(cc3ccccc3c2-c2cccc3ccccc23)C1.
What is the InChIKey of 10-naphthalen-1-yl-1H-anthracen-2-one?
The InChIKey is OPIQCRSTAMOJMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16O/c25-19-12-13-22-18(15-19)14-17-7-2-4-10-21(17)24(22)23-11-5-8-16-6-1-3-9-20(16)23/h1-14H,15H2.
What are the key properties of 10-naphthalen-1-yl-1H-anthracen-2-one?
10-naphthalen-1-yl-1H-anthracen-2-one has a molecular weight of 320.39 g/mol, XLogP of 5.80, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-naphthalen-1-yl-1H-anthracen-2-one is sourced from PubChem (CID 151365518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).