2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one

C17H18O3 — CID 62030765

IUPAC2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one
SMILESCOc1cccc(COC(C)C(=O)c2ccccc2)c1
InChIInChI=1S/C17H18O3/c1-13(17(18)15-8-4-3-5-9-15)20-12-14-7-6-10-16(11-14)19-2/h3-11,13H,12H2,1-2H3
InChIKeyDHANIKYUTWYRIP-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.48
Rot. Bonds6

About 2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one

2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one (PubChem CID 62030765) has the molecular formula C17H18O3 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one.

Molecular Properties

Compound Name2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one
PubChem CID62030765
Molecular FormulaC17H18O3
Molecular Weight270.33 g/mol
Exact Mass270.13
IUPAC Name2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one
SMILESCOc1cccc(COC(C)C(=O)c2ccccc2)c1
InChIInChI=1S/C17H18O3/c1-13(17(18)15-8-4-3-5-9-15)20-12-14-7-6-10-16(11-14)19-2/h3-11,13H,12H2,1-2H3
InChIKeyDHANIKYUTWYRIP-UHFFFAOYSA-N
XLogP3.48
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(3-methoxyphenyl)methoxy]butanoic acid
CID 43536105
N-benzyl-N-ethyl-2-[(3-methoxyphenyl)methoxy]propanamide
CID 86985438
2-[(3-methoxyphenyl)methoxy]-N-(2-phenoxyphenyl)propanamide
CID 46450815
2-chloro-3-(3-methoxyphenyl)-1-phenylpropan-1-one
CID 82185120
2-fluoro-2-[(3-methoxyphenyl)methoxy]acetic acid
CID 79356369
N-(3-aminobutyl)-2-[(3-methoxyphenyl)methoxy]propanamide;hydrochloride
CID 119497040
[4-(4-fluorobenzoyl)phenyl] 2-[(3-methoxyphenyl)methoxy]propanoate
CID 55684573
2-[(4-bromophenyl)methoxy]-1-phenylpropan-1-one
CID 82826900
(2S)-2-[2-[(3-methoxyphenyl)methoxy]propanoylamino]-4-methylpentanoic acid
CID 119361787
(2S,3S)-2-[2-[(3-methoxyphenyl)methoxy]propanoylamino]-3-methylpentanoic acid
CID 119193748
N-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide
CID 46469470
2-[2-[(3-methoxyphenyl)methoxy]propanoylamino]-N-propan-2-ylbenzamide
CID 60552955

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one?
The IUPAC name of 2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one (CID 62030765) is 2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one.
What is the SMILES notation for 2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one?
The canonical SMILES for 2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one is COc1cccc(COC(C)C(=O)c2ccccc2)c1.
What is the InChIKey of 2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one?
The InChIKey is DHANIKYUTWYRIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O3/c1-13(17(18)15-8-4-3-5-9-15)20-12-14-7-6-10-16(11-14)19-2/h3-11,13H,12H2,1-2H3.
What are the key properties of 2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one?
2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one has a molecular weight of 270.33 g/mol, XLogP of 3.48, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxyphenyl)methoxy]-1-phenylpropan-1-one is sourced from PubChem (CID 62030765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).