2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide

C23H25NO5 — CID 147774985

IUPAC2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide
SMILESC=C(c1ccc(OC)cc1NC(=O)CO)c1ccc(OC)c2c1OC(C)(C)C=C2
InChIInChI=1S/C23H25NO5/c1-14(16-7-6-15(27-4)12-19(16)24-21(26)13-25)17-8-9-20(28-5)18-10-11-23(2,3)29-22(17)18/h6-12,25H,1,13H2,2-5H3,(H,24,26)
InChIKeyHGQVGLUPGLHETK-UHFFFAOYSA-N
MW395.46 g/mol
LogP3.88
Rot. Bonds6

About 2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide

2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide (PubChem CID 147774985) has the molecular formula C23H25NO5 and a molecular weight of 395.46 g/mol. Its IUPAC name is 2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide.

Molecular Properties

Compound Name2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide
PubChem CID147774985
Molecular FormulaC23H25NO5
Molecular Weight395.46 g/mol
Exact Mass395.17
IUPAC Name2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide
SMILESC=C(c1ccc(OC)cc1NC(=O)CO)c1ccc(OC)c2c1OC(C)(C)C=C2
InChIInChI=1S/C23H25NO5/c1-14(16-7-6-15(27-4)12-19(16)24-21(26)13-25)17-8-9-20(28-5)18-10-11-23(2,3)29-22(17)18/h6-12,25H,1,13H2,2-5H3,(H,24,26)
InChIKeyHGQVGLUPGLHETK-UHFFFAOYSA-N
XLogP3.88
TPSA77.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.46
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide?
The IUPAC name of 2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide (CID 147774985) is 2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide.
What is the SMILES notation for 2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide?
The canonical SMILES for 2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide is C=C(c1ccc(OC)cc1NC(=O)CO)c1ccc(OC)c2c1OC(C)(C)C=C2.
What is the InChIKey of 2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide?
The InChIKey is HGQVGLUPGLHETK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO5/c1-14(16-7-6-15(27-4)12-19(16)24-21(26)13-25)17-8-9-20(28-5)18-10-11-23(2,3)29-22(17)18/h6-12,25H,1,13H2,2-5H3,(H,24,26).
What are the key properties of 2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide?
2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide has a molecular weight of 395.46 g/mol, XLogP of 3.88, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[5-methoxy-2-[1-(5-methoxy-2,2-dimethylchromen-8-yl)ethenyl]phenyl]acetamide is sourced from PubChem (CID 147774985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).