1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone

C19H16O2 — CID 134094222

IUPAC1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone
SMILESCC(=O)c1ccc(COc2cccc3ccccc23)cc1
InChIInChI=1S/C19H16O2/c1-14(20)16-11-9-15(10-12-16)13-21-19-8-4-6-17-5-2-3-7-18(17)19/h2-12H,13H2,1H3
InChIKeyIAEBHRVGYPIWAP-UHFFFAOYSA-N
MW276.34 g/mol
LogP4.62
Rot. Bonds4

About 1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone

1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone (PubChem CID 134094222) has the molecular formula C19H16O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone.

Molecular Properties

Compound Name1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone
PubChem CID134094222
Molecular FormulaC19H16O2
Molecular Weight276.34 g/mol
Exact Mass276.12
IUPAC Name1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone
SMILESCC(=O)c1ccc(COc2cccc3ccccc23)cc1
InChIInChI=1S/C19H16O2/c1-14(20)16-11-9-15(10-12-16)13-21-19-8-4-6-17-5-2-3-7-18(17)19/h2-12H,13H2,1H3
InChIKeyIAEBHRVGYPIWAP-UHFFFAOYSA-N
XLogP4.62
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(naphthalen-1-yloxymethyl)benzohydrazide
CID 948904
1-[4-[(2-methylphenoxy)methyl]phenyl]ethanone
CID 20716241
1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone
CID 10619405
5-(naphthalen-1-yloxymethyl)pyridine-2-carboxylic acid
CID 118428749
1-(naphthalen-2-ylmethoxy)naphthalene
CID 132511538
3-(naphthalen-1-yloxymethyl)-N-propan-2-ylbenzamide
CID 891835
N'-acetyl-2-naphthalen-1-yloxyacetohydrazide
CID 922179
5-(naphthalen-1-yloxymethyl)furan-2-carboxylate
CID 3596350
methyl 4-[(2-acetylphenoxy)methyl]benzoate
CID 9172369
2-naphthalen-1-yloxyethyl acetate
CID 23049663
(3-acetylphenyl) 4-[(2-methoxyphenoxy)methyl]benzoate
CID 126184010
5-phenylmethoxynaphthalen-2-ol
CID 71348952

Frequently Asked Questions

What is the IUPAC name of 1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone?
The IUPAC name of 1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone (CID 134094222) is 1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone.
What is the SMILES notation for 1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone?
The canonical SMILES for 1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone is CC(=O)c1ccc(COc2cccc3ccccc23)cc1.
What is the InChIKey of 1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone?
The InChIKey is IAEBHRVGYPIWAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16O2/c1-14(20)16-11-9-15(10-12-16)13-21-19-8-4-6-17-5-2-3-7-18(17)19/h2-12H,13H2,1H3.
What are the key properties of 1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone?
1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone has a molecular weight of 276.34 g/mol, XLogP of 4.62, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone is sourced from PubChem (CID 134094222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).