7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one

C18H16O4 — CID 134910542

IUPAC7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one
SMILESCOc1cccc(-c2cc(=O)c3cc(C)c(OC)cc3o2)c1
InChIInChI=1S/C18H16O4/c1-11-7-14-15(19)9-17(22-18(14)10-16(11)21-3)12-5-4-6-13(8-12)20-2/h4-10H,1-3H3
InChIKeyBPKDFAVWJZNTMO-UHFFFAOYSA-N
MW296.32 g/mol
LogP3.79
Rot. Bonds3

About 7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one

7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one (PubChem CID 134910542) has the molecular formula C18H16O4 and a molecular weight of 296.32 g/mol. Its IUPAC name is 7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one.

Molecular Properties

Compound Name7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one
PubChem CID134910542
Molecular FormulaC18H16O4
Molecular Weight296.32 g/mol
Exact Mass296.10
IUPAC Name7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one
SMILESCOc1cccc(-c2cc(=O)c3cc(C)c(OC)cc3o2)c1
InChIInChI=1S/C18H16O4/c1-11-7-14-15(19)9-17(22-18(14)10-16(11)21-3)12-5-4-6-13(8-12)20-2/h4-10H,1-3H3
InChIKeyBPKDFAVWJZNTMO-UHFFFAOYSA-N
XLogP3.79
TPSA48.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.32
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-(dimethylamino)-2-(3-methoxyphenyl)chromen-4-one
CID 23001746
6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one
CID 155754088
6-methoxy-2-phenylchromen-4-one;hydrate
CID 174958280
2-(2-methoxyphenyl)-6,7-dimethylchromen-4-one
CID 13190885
5-(3-methoxyphenyl)-2,3-dimethylfuran
CID 70996763
2-(3,5-dimethylphenyl)-6-methoxychromen-4-one
CID 166633270
6-amino-2-(3,4-dimethoxyphenyl)-7-methoxychromen-4-one
CID 72705992
N-(7-methoxy-4-oxo-2-phenylchromen-6-yl)acetamide
CID 121366062
6-methoxy-2-(2-methoxyphenyl)chromen-4-one
CID 676288
2-(6-methoxynaphthalen-2-yl)chromen-4-one
CID 132606136
2-(3-amino-4-methylphenyl)-5-methoxychromen-4-one
CID 71421837
2-(4-bromophenyl)-7-methoxychromen-4-one
CID 25032618

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one?
The IUPAC name of 7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one (CID 134910542) is 7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one.
What is the SMILES notation for 7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one?
The canonical SMILES for 7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one is COc1cccc(-c2cc(=O)c3cc(C)c(OC)cc3o2)c1.
What is the InChIKey of 7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one?
The InChIKey is BPKDFAVWJZNTMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16O4/c1-11-7-14-15(19)9-17(22-18(14)10-16(11)21-3)12-5-4-6-13(8-12)20-2/h4-10H,1-3H3.
What are the key properties of 7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one?
7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one has a molecular weight of 296.32 g/mol, XLogP of 3.79, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one is sourced from PubChem (CID 134910542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).