1-naphthalen-2-yl-2-phenylethanone

C18H14O — CID 2749464

IUPAC1-naphthalen-2-yl-2-phenylethanone
SMILESO=C(Cc1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C18H14O/c19-18(12-14-6-2-1-3-7-14)17-11-10-15-8-4-5-9-16(15)13-17/h1-11,13H,12H2
InChIKeyFKBYIMMMZSGHHV-UHFFFAOYSA-N
MW246.31 g/mol
LogP4.27
Rot. Bonds3

About 1-naphthalen-2-yl-2-phenylethanone

1-naphthalen-2-yl-2-phenylethanone (PubChem CID 2749464) has the molecular formula C18H14O and a molecular weight of 246.31 g/mol. Its IUPAC name is 1-naphthalen-2-yl-2-phenylethanone.

Molecular Properties

Compound Name1-naphthalen-2-yl-2-phenylethanone
PubChem CID2749464
Molecular FormulaC18H14O
Molecular Weight246.31 g/mol
Exact Mass246.10
IUPAC Name1-naphthalen-2-yl-2-phenylethanone
SMILESO=C(Cc1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C18H14O/c19-18(12-14-6-2-1-3-7-14)17-11-10-15-8-4-5-9-16(15)13-17/h1-11,13H,12H2
InChIKeyFKBYIMMMZSGHHV-UHFFFAOYSA-N
XLogP4.27
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-2-phenylethanone?
The IUPAC name of 1-naphthalen-2-yl-2-phenylethanone (CID 2749464) is 1-naphthalen-2-yl-2-phenylethanone.
What is the SMILES notation for 1-naphthalen-2-yl-2-phenylethanone?
The canonical SMILES for 1-naphthalen-2-yl-2-phenylethanone is O=C(Cc1ccccc1)c1ccc2ccccc2c1.
What is the InChIKey of 1-naphthalen-2-yl-2-phenylethanone?
The InChIKey is FKBYIMMMZSGHHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14O/c19-18(12-14-6-2-1-3-7-14)17-11-10-15-8-4-5-9-16(15)13-17/h1-11,13H,12H2.
What are the key properties of 1-naphthalen-2-yl-2-phenylethanone?
1-naphthalen-2-yl-2-phenylethanone has a molecular weight of 246.31 g/mol, XLogP of 4.27, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-2-phenylethanone is sourced from PubChem (CID 2749464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).