4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one

C23H23NO5 — CID 50906216

IUPAC4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one
SMILESCOc1ccc2cc(C3CC(=O)N3c3cc(OC)c(OC)c(OC)c3)ccc2c1
InChIInChI=1S/C23H23NO5/c1-26-18-8-7-14-9-16(6-5-15(14)10-18)19-13-22(25)24(19)17-11-20(27-2)23(29-4)21(12-17)28-3/h5-12,19H,13H2,1-4H3
InChIKeyWSENLUVSKPYZHG-UHFFFAOYSA-N
MW393.44 g/mol
LogP4.35
Rot. Bonds6

About 4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one

4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one (PubChem CID 50906216) has the molecular formula C23H23NO5 and a molecular weight of 393.44 g/mol. Its IUPAC name is 4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one.

Molecular Properties

Compound Name4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one
PubChem CID50906216
Molecular FormulaC23H23NO5
Molecular Weight393.44 g/mol
Exact Mass393.16
IUPAC Name4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one
SMILESCOc1ccc2cc(C3CC(=O)N3c3cc(OC)c(OC)c(OC)c3)ccc2c1
InChIInChI=1S/C23H23NO5/c1-26-18-8-7-14-9-16(6-5-15(14)10-18)19-13-22(25)24(19)17-11-20(27-2)23(29-4)21(12-17)28-3/h5-12,19H,13H2,1-4H3
InChIKeyWSENLUVSKPYZHG-UHFFFAOYSA-N
XLogP4.35
TPSA57.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.44
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one?
The IUPAC name of 4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one (CID 50906216) is 4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one.
What is the SMILES notation for 4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one?
The canonical SMILES for 4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one is COc1ccc2cc(C3CC(=O)N3c3cc(OC)c(OC)c(OC)c3)ccc2c1.
What is the InChIKey of 4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one?
The InChIKey is WSENLUVSKPYZHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO5/c1-26-18-8-7-14-9-16(6-5-15(14)10-18)19-13-22(25)24(19)17-11-20(27-2)23(29-4)21(12-17)28-3/h5-12,19H,13H2,1-4H3.
What are the key properties of 4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one?
4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one has a molecular weight of 393.44 g/mol, XLogP of 4.35, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methoxynaphthalen-2-yl)-1-(3,4,5-trimethoxyphenyl)azetidin-2-one is sourced from PubChem (CID 50906216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).