8-ethyl-3-methyl-2-phenylchromen-4-one

C18H16O2 — CID 59679615

IUPAC8-ethyl-3-methyl-2-phenylchromen-4-one
SMILESCCc1cccc2c(=O)c(C)c(-c3ccccc3)oc12
InChIInChI=1S/C18H16O2/c1-3-13-10-7-11-15-16(19)12(2)17(20-18(13)15)14-8-5-4-6-9-14/h4-11H,3H2,1-2H3
InChIKeyONPJWVPZIIUETO-UHFFFAOYSA-N
MW264.32 g/mol
LogP4.33
Rot. Bonds2

About 8-ethyl-3-methyl-2-phenylchromen-4-one

8-ethyl-3-methyl-2-phenylchromen-4-one (PubChem CID 59679615) has the molecular formula C18H16O2 and a molecular weight of 264.32 g/mol. Its IUPAC name is 8-ethyl-3-methyl-2-phenylchromen-4-one.

Molecular Properties

Compound Name8-ethyl-3-methyl-2-phenylchromen-4-one
PubChem CID59679615
Molecular FormulaC18H16O2
Molecular Weight264.32 g/mol
Exact Mass264.12
IUPAC Name8-ethyl-3-methyl-2-phenylchromen-4-one
SMILESCCc1cccc2c(=O)c(C)c(-c3ccccc3)oc12
InChIInChI=1S/C18H16O2/c1-3-13-10-7-11-15-16(19)12(2)17(20-18(13)15)14-8-5-4-6-9-14/h4-11H,3H2,1-2H3
InChIKeyONPJWVPZIIUETO-UHFFFAOYSA-N
XLogP4.33
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-ethyl-3-methyl-2-phenylchromen-4-one?
The IUPAC name of 8-ethyl-3-methyl-2-phenylchromen-4-one (CID 59679615) is 8-ethyl-3-methyl-2-phenylchromen-4-one.
What is the SMILES notation for 8-ethyl-3-methyl-2-phenylchromen-4-one?
The canonical SMILES for 8-ethyl-3-methyl-2-phenylchromen-4-one is CCc1cccc2c(=O)c(C)c(-c3ccccc3)oc12.
What is the InChIKey of 8-ethyl-3-methyl-2-phenylchromen-4-one?
The InChIKey is ONPJWVPZIIUETO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16O2/c1-3-13-10-7-11-15-16(19)12(2)17(20-18(13)15)14-8-5-4-6-9-14/h4-11H,3H2,1-2H3.
What are the key properties of 8-ethyl-3-methyl-2-phenylchromen-4-one?
8-ethyl-3-methyl-2-phenylchromen-4-one has a molecular weight of 264.32 g/mol, XLogP of 4.33, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-3-methyl-2-phenylchromen-4-one is sourced from PubChem (CID 59679615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).