(5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone

C24H24O5 — CID 118199572

IUPAC(5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone
SMILESCOc1cc2c(cc1C)OCC=C2C(=O)c1ccc2c(c1OC)C=CC(C)(C)O2
InChIInChI=1S/C24H24O5/c1-14-12-21-18(13-20(14)26-4)15(9-11-28-21)22(25)17-6-7-19-16(23(17)27-5)8-10-24(2,3)29-19/h6-10,12-13H,11H2,1-5H3
InChIKeyGAYTXIXCHURERP-UHFFFAOYSA-N
MW392.45 g/mol
LogP4.86
Rot. Bonds4

About (5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone

(5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone (PubChem CID 118199572) has the molecular formula C24H24O5 and a molecular weight of 392.45 g/mol. Its IUPAC name is (5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone.

Molecular Properties

Compound Name(5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone
PubChem CID118199572
Molecular FormulaC24H24O5
Molecular Weight392.45 g/mol
Exact Mass392.16
IUPAC Name(5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone
SMILESCOc1cc2c(cc1C)OCC=C2C(=O)c1ccc2c(c1OC)C=CC(C)(C)O2
InChIInChI=1S/C24H24O5/c1-14-12-21-18(13-20(14)26-4)15(9-11-28-21)22(25)17-6-7-19-16(23(17)27-5)8-10-24(2,3)29-19/h6-10,12-13H,11H2,1-5H3
InChIKeyGAYTXIXCHURERP-UHFFFAOYSA-N
XLogP4.86
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.45
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(5-methoxy-2,2-dimethylchromen-6-yl)ethanone
CID 10879004
1-(5-methoxy-2,2-dimethylchromen-6-yl)-2-(3-methoxy-4-methylphenyl)butan-1-one
CID 118199588
(2S)-1-(5-methoxy-2,2-dimethylchromen-6-yl)-2-(3-methoxy-4-methylphenyl)propan-1-one;(2S)-2-(3-methoxy-4-methylphenyl)propanal;sulfane
CID 161356678
5-[[(3R)-6,7-dimethoxy-4-oxo-2,3-dihydrochromen-3-yl]oxy]-2,2-dimethylchromene-6-carboxylic acid
CID 162933767
(3S)-3-(3-methoxy-4-methylphenyl)-8,8-dimethyl-2,3-dihydropyrano[2,3-f]chromen-4-one
CID 118199562
1-(5-hydroxy-2,2-dimethylchromen-6-yl)-2-(3-methoxy-4-methylphenyl)ethanone
CID 118199612
1-(5-methoxy-2,2-dimethylchromen-6-yl)-2-(3-methoxy-4-methylphenyl)-2-methylpropan-1-one;2-(3-methoxy-4-methylphenyl)-1-(2,2,5-trimethylchromen-6-yl)ethanone
CID 157442776
1-(5,7-dimethoxy-2,2-dimethylchromen-6-yl)ethanone
CID 66573258
N-(7-methoxy-2,2-dimethyl-3H-1-benzofuran-5-yl)-6-methyl-2H-chromene-4-carboxamide
CID 141388517
4-(3,4-dimethoxyphenoxy)-1-(5-methoxy-2,2-dimethylchromen-6-yl)but-2-yn-1-one
CID 11292723
(6-acetyl-2,2-dimethylchromen-5-yl) acetate
CID 162951359
17,18-dimethoxy-7,7-dimethyl-2,8,22-trioxapentacyclo[12.8.0.03,12.04,9.015,20]docosa-1(14),3(12),4(9),5,10,15,17,19-octaen-13-one
CID 89257140

Frequently Asked Questions

What is the IUPAC name of (5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone?
The IUPAC name of (5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone (CID 118199572) is (5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone.
What is the SMILES notation for (5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone?
The canonical SMILES for (5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone is COc1cc2c(cc1C)OCC=C2C(=O)c1ccc2c(c1OC)C=CC(C)(C)O2.
What is the InChIKey of (5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone?
The InChIKey is GAYTXIXCHURERP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24O5/c1-14-12-21-18(13-20(14)26-4)15(9-11-28-21)22(25)17-6-7-19-16(23(17)27-5)8-10-24(2,3)29-19/h6-10,12-13H,11H2,1-5H3.
What are the key properties of (5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone?
(5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone has a molecular weight of 392.45 g/mol, XLogP of 4.86, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxy-2,2-dimethylchromen-6-yl)-(6-methoxy-7-methyl-2H-chromen-4-yl)methanone is sourced from PubChem (CID 118199572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).