1-naphthalen-1-yl-3-phenylpropan-1-one

C19H16O — CID 20764678

IUPAC1-naphthalen-1-yl-3-phenylpropan-1-one
SMILESO=C(CCc1ccccc1)c1cccc2ccccc12
InChIInChI=1S/C19H16O/c20-19(14-13-15-7-2-1-3-8-15)18-12-6-10-16-9-4-5-11-17(16)18/h1-12H,13-14H2
InChIKeyBMHOIHYRBIYOTF-UHFFFAOYSA-N
MW260.34 g/mol
LogP4.66
Rot. Bonds4

About 1-naphthalen-1-yl-3-phenylpropan-1-one

1-naphthalen-1-yl-3-phenylpropan-1-one (PubChem CID 20764678) has the molecular formula C19H16O and a molecular weight of 260.34 g/mol. Its IUPAC name is 1-naphthalen-1-yl-3-phenylpropan-1-one.

Molecular Properties

Compound Name1-naphthalen-1-yl-3-phenylpropan-1-one
PubChem CID20764678
Molecular FormulaC19H16O
Molecular Weight260.34 g/mol
Exact Mass260.12
IUPAC Name1-naphthalen-1-yl-3-phenylpropan-1-one
SMILESO=C(CCc1ccccc1)c1cccc2ccccc12
InChIInChI=1S/C19H16O/c20-19(14-13-15-7-2-1-3-8-15)18-12-6-10-16-9-4-5-11-17(16)18/h1-12H,13-14H2
InChIKeyBMHOIHYRBIYOTF-UHFFFAOYSA-N
XLogP4.66
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-hydroxy-1-naphthalen-1-ylpropan-1-one
CID 19872190
1-(9H-carbazol-1-yl)-3-phenylpropan-1-one
CID 2793732
1-naphthalen-1-yl-3-phenoxypropan-1-one
CID 62717239
4-methyl-1-naphthalen-1-ylpent-4-en-1-one
CID 114473529
1-(3-amino-2-methylphenyl)-3-phenylpropan-1-one
CID 116604350
1-(3-fluoro-2-methylphenyl)-3-phenylpropan-1-one
CID 146006893
tris(naphthalene-1-carboxylic acid);phosphane
CID 172834804
1-naphthalen-1-yldodecan-1-one
CID 3424169
1-(2-methylsulfanylphenyl)-3-phenylpropan-1-one
CID 24725579
1-naphthalen-1-yl-4-[2-[2-(4-naphthalen-1-yl-4-oxobutoxy)ethoxy]ethoxy]butan-1-one
CID 157326026
3-cyclohexa-1,5-dien-1-yl-1-naphthalen-1-ylpropan-1-one
CID 144547691
1-(4-methoxyphenyl)-4-naphthalen-1-ylbutane-1,4-dione
CID 14529191

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-yl-3-phenylpropan-1-one?
The IUPAC name of 1-naphthalen-1-yl-3-phenylpropan-1-one (CID 20764678) is 1-naphthalen-1-yl-3-phenylpropan-1-one.
What is the SMILES notation for 1-naphthalen-1-yl-3-phenylpropan-1-one?
The canonical SMILES for 1-naphthalen-1-yl-3-phenylpropan-1-one is O=C(CCc1ccccc1)c1cccc2ccccc12.
What is the InChIKey of 1-naphthalen-1-yl-3-phenylpropan-1-one?
The InChIKey is BMHOIHYRBIYOTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16O/c20-19(14-13-15-7-2-1-3-8-15)18-12-6-10-16-9-4-5-11-17(16)18/h1-12H,13-14H2.
What are the key properties of 1-naphthalen-1-yl-3-phenylpropan-1-one?
1-naphthalen-1-yl-3-phenylpropan-1-one has a molecular weight of 260.34 g/mol, XLogP of 4.66, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-yl-3-phenylpropan-1-one is sourced from PubChem (CID 20764678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).