2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one

C18H16O3 — CID 13190885

IUPAC2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one
SMILESCOc1ccccc1-c1cc(=O)c2cc(C)c(C)cc2o1
InChIInChI=1S/C18H16O3/c1-11-8-14-15(19)10-18(21-17(14)9-12(11)2)13-6-4-5-7-16(13)20-3/h4-10H,1-3H3
InChIKeyHLZRRVZZQWJBDO-UHFFFAOYSA-N
MW280.32 g/mol
LogP4.09
Rot. Bonds2

About 2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one

2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one (PubChem CID 13190885) has the molecular formula C18H16O3 and a molecular weight of 280.32 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one
PubChem CID13190885
Molecular FormulaC18H16O3
Molecular Weight280.32 g/mol
Exact Mass280.11
IUPAC Name2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one
SMILESCOc1ccccc1-c1cc(=O)c2cc(C)c(C)cc2o1
InChIInChI=1S/C18H16O3/c1-11-8-14-15(19)10-18(21-17(14)9-12(11)2)13-6-4-5-7-16(13)20-3/h4-10H,1-3H3
InChIKeyHLZRRVZZQWJBDO-UHFFFAOYSA-N
XLogP4.09
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-methoxy-2-(2-methoxyphenyl)chromen-4-one
CID 676288
N-[2-(2-methoxyphenyl)-4-oxochromen-6-yl]-2-methylbenzamide
CID 18568738
5-hydroxy-2-(2-methoxyphenyl)chromen-4-one
CID 688677
2-(2,3-dimethoxyphenyl)-7-hydroxychromen-4-one
CID 127031650
4-fluoro-N-[2-(2-methoxyphenyl)-4-oxochromen-6-yl]benzenesulfonamide
CID 16801695
7-bromo-2-(2-hydroxyphenyl)-6-methylchromen-4-one
CID 100964512
2-(2-methoxyphenyl)-6-methyl-1-benzofuran-4-carboxylic acid
CID 175186064
7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one
CID 134910542
3,4-dimethoxy-N-[2-(2-methoxyphenyl)-4-oxochromen-6-yl]benzamide
CID 16801698
4-chloro-N-[2-(2-methoxyphenyl)-4-oxochromen-7-yl]benzamide
CID 98476084
N-[2-(2-methoxyphenyl)-4-oxochromen-7-yl]cyclohexanecarboxamide
CID 98476168
N-[2-(2-methoxyphenyl)-4-oxochromen-7-yl]thiophene-2-carboxamide
CID 98476004

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one?
The IUPAC name of 2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one (CID 13190885) is 2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one.
What is the SMILES notation for 2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one?
The canonical SMILES for 2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one is COc1ccccc1-c1cc(=O)c2cc(C)c(C)cc2o1.
What is the InChIKey of 2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one?
The InChIKey is HLZRRVZZQWJBDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16O3/c1-11-8-14-15(19)10-18(21-17(14)9-12(11)2)13-6-4-5-7-16(13)20-3/h4-10H,1-3H3.
What are the key properties of 2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one?
2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one has a molecular weight of 280.32 g/mol, XLogP of 4.09, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one is sourced from PubChem (CID 13190885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).