2-methoxy-1-naphthalen-2-ylpropan-1-one

C14H14O2 — CID 79616176

IUPAC2-methoxy-1-naphthalen-2-ylpropan-1-one
SMILESCOC(C)C(=O)c1ccc2ccccc2c1
InChIInChI=1S/C14H14O2/c1-10(16-2)14(15)13-8-7-11-5-3-4-6-12(11)9-13/h3-10H,1-2H3
InChIKeyOJEXSMYHJYSUGA-UHFFFAOYSA-N
MW214.26 g/mol
LogP3.06
Rot. Bonds3

About 2-methoxy-1-naphthalen-2-ylpropan-1-one

2-methoxy-1-naphthalen-2-ylpropan-1-one (PubChem CID 79616176) has the molecular formula C14H14O2 and a molecular weight of 214.26 g/mol. Its IUPAC name is 2-methoxy-1-naphthalen-2-ylpropan-1-one.

Molecular Properties

Compound Name2-methoxy-1-naphthalen-2-ylpropan-1-one
PubChem CID79616176
Molecular FormulaC14H14O2
Molecular Weight214.26 g/mol
Exact Mass214.10
IUPAC Name2-methoxy-1-naphthalen-2-ylpropan-1-one
SMILESCOC(C)C(=O)c1ccc2ccccc2c1
InChIInChI=1S/C14H14O2/c1-10(16-2)14(15)13-8-7-11-5-3-4-6-12(11)9-13/h3-10H,1-2H3
InChIKeyOJEXSMYHJYSUGA-UHFFFAOYSA-N
XLogP3.06
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-hydroxy-1-naphthalen-2-ylpropan-1-one
CID 10130388
(2R)-2-chloro-1-naphthalen-2-ylpropan-1-one
CID 93494503
(2R)-2-amino-1-naphthalen-2-ylpropan-1-one
CID 67852700
(2S)-1-naphthalen-2-yl-2-(propan-2-ylamino)propan-1-one
CID 781909
dimethyl 2,4-bis(naphthalene-2-carbonyl)pentanedioate
CID 102483861
ethane;methyl naphthalene-2-carboxylate
CID 143895262
methyl 2-naphthalen-2-yl-2-oxoacetate
CID 3726008
2-amino-3-methoxy-1-naphthalen-2-ylpropan-1-one
CID 116594058
[(2S)-1-(3-chlorophenyl)-1-oxopropan-2-yl] naphthalene-2-carboxylate
CID 26202065
[(2S)-1-(4-ethylphenyl)-1-oxopropan-2-yl] naphthalene-2-carboxylate
CID 7698131
3-methyl-2-(methylaminomethyl)-1-naphthalen-2-ylbutan-1-one
CID 116923574
2-methoxy-1-naphthalen-2-yltetradecan-1-one
CID 20979765

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-naphthalen-2-ylpropan-1-one?
The IUPAC name of 2-methoxy-1-naphthalen-2-ylpropan-1-one (CID 79616176) is 2-methoxy-1-naphthalen-2-ylpropan-1-one.
What is the SMILES notation for 2-methoxy-1-naphthalen-2-ylpropan-1-one?
The canonical SMILES for 2-methoxy-1-naphthalen-2-ylpropan-1-one is COC(C)C(=O)c1ccc2ccccc2c1.
What is the InChIKey of 2-methoxy-1-naphthalen-2-ylpropan-1-one?
The InChIKey is OJEXSMYHJYSUGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O2/c1-10(16-2)14(15)13-8-7-11-5-3-4-6-12(11)9-13/h3-10H,1-2H3.
What are the key properties of 2-methoxy-1-naphthalen-2-ylpropan-1-one?
2-methoxy-1-naphthalen-2-ylpropan-1-one has a molecular weight of 214.26 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-naphthalen-2-ylpropan-1-one is sourced from PubChem (CID 79616176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).