3-methoxy-2-(2-methoxyphenyl)chromen-4-one

C17H14O4 — CID 676169

IUPAC3-methoxy-2-(2-methoxyphenyl)chromen-4-one
SMILESCOc1ccccc1-c1oc2ccccc2c(=O)c1OC
InChIInChI=1S/C17H14O4/c1-19-13-9-5-4-8-12(13)16-17(20-2)15(18)11-7-3-6-10-14(11)21-16/h3-10H,1-2H3
InChIKeySJZIKJCJJAPNQI-UHFFFAOYSA-N
MW282.30 g/mol
LogP3.48
Rot. Bonds3

About 3-methoxy-2-(2-methoxyphenyl)chromen-4-one

3-methoxy-2-(2-methoxyphenyl)chromen-4-one (PubChem CID 676169) has the molecular formula C17H14O4 and a molecular weight of 282.30 g/mol. Its IUPAC name is 3-methoxy-2-(2-methoxyphenyl)chromen-4-one.

Molecular Properties

Compound Name3-methoxy-2-(2-methoxyphenyl)chromen-4-one
PubChem CID676169
Molecular FormulaC17H14O4
Molecular Weight282.30 g/mol
Exact Mass282.09
IUPAC Name3-methoxy-2-(2-methoxyphenyl)chromen-4-one
SMILESCOc1ccccc1-c1oc2ccccc2c(=O)c1OC
InChIInChI=1S/C17H14O4/c1-19-13-9-5-4-8-12(13)16-17(20-2)15(18)11-7-3-6-10-14(11)21-16/h3-10H,1-2H3
InChIKeySJZIKJCJJAPNQI-UHFFFAOYSA-N
XLogP3.48
TPSA48.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(2-methoxyphenyl)-4-oxochromen-3-yl] hydrogen carbonate
CID 67869250
2-[2-(2-methoxyphenyl)-4-oxochromen-3-yl]oxypropanoic acid
CID 20983860
3-methoxy-2-(4-methylphenyl)chromen-4-one
CID 139049420
ethyl 2-[2-(2-methoxyphenyl)-4-oxochromen-3-yl]acetate
CID 139291625
[2-acetyloxy-3-(3-acetyloxy-4-oxochromen-2-yl)phenyl] acetate
CID 134303208
3-hydroxy-2-(2-methoxy-5-methylphenyl)chromen-4-one
CID 71733634
6-[2-(2,3-dimethoxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
CID 154700123
2-(5-bromo-2,3-dimethoxyphenyl)-3-hydroxychromen-4-one
CID 71735018
2-(2-methoxyphenyl)-4-sulfanylidenechromene-3-carbonitrile
CID 134911456
2-(3,4-dimethoxyphenyl)-3-phenylchromen-4-one
CID 140540725
4-[5-(2-methoxyphenyl)furan-2-yl]chromen-2-one
CID 135259598
2-(2,3-dimethoxyphenyl)-3-hydroxy-5-methoxychromen-4-one
CID 172643077

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-(2-methoxyphenyl)chromen-4-one?
The IUPAC name of 3-methoxy-2-(2-methoxyphenyl)chromen-4-one (CID 676169) is 3-methoxy-2-(2-methoxyphenyl)chromen-4-one.
What is the SMILES notation for 3-methoxy-2-(2-methoxyphenyl)chromen-4-one?
The canonical SMILES for 3-methoxy-2-(2-methoxyphenyl)chromen-4-one is COc1ccccc1-c1oc2ccccc2c(=O)c1OC.
What is the InChIKey of 3-methoxy-2-(2-methoxyphenyl)chromen-4-one?
The InChIKey is SJZIKJCJJAPNQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14O4/c1-19-13-9-5-4-8-12(13)16-17(20-2)15(18)11-7-3-6-10-14(11)21-16/h3-10H,1-2H3.
What are the key properties of 3-methoxy-2-(2-methoxyphenyl)chromen-4-one?
3-methoxy-2-(2-methoxyphenyl)chromen-4-one has a molecular weight of 282.30 g/mol, XLogP of 3.48, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-(2-methoxyphenyl)chromen-4-one is sourced from PubChem (CID 676169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).