2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide

C24H19NO6 — CID 71728214

IUPAC2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)COc2cc(O)c3c(=O)cc(-c4ccccc4)oc3c2)c1
InChIInChI=1S/C24H19NO6/c1-29-17-9-5-8-16(10-17)25-23(28)14-30-18-11-19(26)24-20(27)13-21(31-22(24)12-18)15-6-3-2-4-7-15/h2-13,26H,14H2,1H3,(H,25,28)
InChIKeyDIGSNNDESAUXRO-UHFFFAOYSA-N
MW417.42 g/mol
LogP4.19
Rot. Bonds6

About 2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide

2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide (PubChem CID 71728214) has the molecular formula C24H19NO6 and a molecular weight of 417.42 g/mol. Its IUPAC name is 2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide
PubChem CID71728214
Molecular FormulaC24H19NO6
Molecular Weight417.42 g/mol
Exact Mass417.12
IUPAC Name2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)COc2cc(O)c3c(=O)cc(-c4ccccc4)oc3c2)c1
InChIInChI=1S/C24H19NO6/c1-29-17-9-5-8-16(10-17)25-23(28)14-30-18-11-19(26)24-20(27)13-21(31-22(24)12-18)15-6-3-2-4-7-15/h2-13,26H,14H2,1H3,(H,25,28)
InChIKeyDIGSNNDESAUXRO-UHFFFAOYSA-N
XLogP4.19
TPSA98.00 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.42
LogP ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 60836
CID 60836
CID 16756067
CID 16756067
CID 91937891
CID 91937891
CID 91937890
CID 91937890
CID 1082766
CID 1082766
CID 2728610
CID 2728610
CID 137642116
CID 137642116
CID 155563026
CID 155563026
CID 11688386
CID 11688386
CID 142727293
CID 142727293
CID 4990145
CID 4990145
CID 21226360
CID 21226360

Frequently Asked Questions

What is the IUPAC name of 2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide (CID 71728214) is 2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide is COc1cccc(NC(=O)COc2cc(O)c3c(=O)cc(-c4ccccc4)oc3c2)c1.
What is the InChIKey of 2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide?
The InChIKey is DIGSNNDESAUXRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO6/c1-29-17-9-5-8-16(10-17)25-23(28)14-30-18-11-19(26)24-20(27)13-21(31-22(24)12-18)15-6-3-2-4-7-15/h2-13,26H,14H2,1H3,(H,25,28).
What are the key properties of 2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide?
2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide has a molecular weight of 417.42 g/mol, XLogP of 4.19, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxy-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 71728214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).