2-naphthalen-1-yl-2,3-dihydrochromen-4-one

C19H14O2 — CID 12753196

IUPAC2-naphthalen-1-yl-2,3-dihydrochromen-4-one
SMILESO=C1CC(c2cccc3ccccc23)Oc2ccccc21
InChIInChI=1S/C19H14O2/c20-17-12-19(21-18-11-4-3-9-16(17)18)15-10-5-7-13-6-1-2-8-14(13)15/h1-11,19H,12H2
InChIKeyUPZUEXDENBCKAD-UHFFFAOYSA-N
MW274.32 g/mol
LogP4.55
Rot. Bonds1

About 2-naphthalen-1-yl-2,3-dihydrochromen-4-one

2-naphthalen-1-yl-2,3-dihydrochromen-4-one (PubChem CID 12753196) has the molecular formula C19H14O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-naphthalen-1-yl-2,3-dihydrochromen-4-one.

Molecular Properties

Compound Name2-naphthalen-1-yl-2,3-dihydrochromen-4-one
PubChem CID12753196
Molecular FormulaC19H14O2
Molecular Weight274.32 g/mol
Exact Mass274.10
IUPAC Name2-naphthalen-1-yl-2,3-dihydrochromen-4-one
SMILESO=C1CC(c2cccc3ccccc23)Oc2ccccc21
InChIInChI=1S/C19H14O2/c20-17-12-19(21-18-11-4-3-9-16(17)18)15-10-5-7-13-6-1-2-8-14(13)15/h1-11,19H,12H2
InChIKeyUPZUEXDENBCKAD-UHFFFAOYSA-N
XLogP4.55
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-fluoro-3-methylphenyl)-2,3-dihydrochromen-4-one
CID 91411003
(3R)-3-naphthalen-1-yl-2,3-dihydroinden-1-one
CID 134952620
(5S)-3-methylidene-5-naphthalen-1-yloxolan-2-one
CID 102168852
ethane;2-phenyl-2,3-dihydrochromen-4-one
CID 91018475
2-(4-chloroquinolin-2-yl)-2,3-dihydrochromen-4-one
CID 132571075
[3-(4-oxo-2,3-dihydrochromen-2-yl)phenyl]boronic acid
CID 71504747
(2R)-2-(3-fluorophenyl)-2,3-dihydrochromen-4-one
CID 70363390
2-(2,5-dimethylthiophen-3-yl)-2,3-dihydrochromen-4-one
CID 114671481
2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine
CID 114709441
(4S)-2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-amine
CID 104945921
(2S,4S)-2-naphthalen-1-yl-3,4-dihydro-2H-chromen-4-ol
CID 134948340
2-(4-methylphenyl)-2,3-dihydrochromen-4-one
CID 2802466

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-2,3-dihydrochromen-4-one?
The IUPAC name of 2-naphthalen-1-yl-2,3-dihydrochromen-4-one (CID 12753196) is 2-naphthalen-1-yl-2,3-dihydrochromen-4-one.
What is the SMILES notation for 2-naphthalen-1-yl-2,3-dihydrochromen-4-one?
The canonical SMILES for 2-naphthalen-1-yl-2,3-dihydrochromen-4-one is O=C1CC(c2cccc3ccccc23)Oc2ccccc21.
What is the InChIKey of 2-naphthalen-1-yl-2,3-dihydrochromen-4-one?
The InChIKey is UPZUEXDENBCKAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14O2/c20-17-12-19(21-18-11-4-3-9-16(17)18)15-10-5-7-13-6-1-2-8-14(13)15/h1-11,19H,12H2.
What are the key properties of 2-naphthalen-1-yl-2,3-dihydrochromen-4-one?
2-naphthalen-1-yl-2,3-dihydrochromen-4-one has a molecular weight of 274.32 g/mol, XLogP of 4.55, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-2,3-dihydrochromen-4-one is sourced from PubChem (CID 12753196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).