N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide

C19H20N2O4 — CID 110405753

IUPACN-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)Nc1ccc2c(c1)C(C)(C)C(=O)N2
InChIInChI=1S/C19H20N2O4/c1-19(2)13-10-12(8-9-14(13)21-18(19)23)20-17(22)11-25-16-7-5-4-6-15(16)24-3/h4-10H,11H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyXZEABPMBLMTDPW-UHFFFAOYSA-N
MW340.38 g/mol
LogP2.94
Rot. Bonds5

About N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide

N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide (PubChem CID 110405753) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide
PubChem CID110405753
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC NameN-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)Nc1ccc2c(c1)C(C)(C)C(=O)N2
InChIInChI=1S/C19H20N2O4/c1-19(2)13-10-12(8-9-14(13)21-18(19)23)20-17(22)11-25-16-7-5-4-6-15(16)24-3/h4-10H,11H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyXZEABPMBLMTDPW-UHFFFAOYSA-N
XLogP2.94
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide (CID 110405753) is N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide is COc1ccccc1OCC(=O)Nc1ccc2c(c1)C(C)(C)C(=O)N2.
What is the InChIKey of N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide?
The InChIKey is XZEABPMBLMTDPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-19(2)13-10-12(8-9-14(13)21-18(19)23)20-17(22)11-25-16-7-5-4-6-15(16)24-3/h4-10H,11H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide?
N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide has a molecular weight of 340.38 g/mol, XLogP of 2.94, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 110405753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).