2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide

C20H26N4O3 — CID 126953538

IUPAC2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide
SMILESCN1CCC(N2CCC(Oc3cccc4c3ccn4CC(N)=O)CC2)C1=O
InChIInChI=1S/C20H26N4O3/c1-22-9-8-17(20(22)26)23-10-5-14(6-11-23)27-18-4-2-3-16-15(18)7-12-24(16)13-19(21)25/h2-4,7,12,14,17H,5-6,8-11,13H2,1H3,(H2,21,25)
InChIKeyHTZSKFJPWBDKOZ-UHFFFAOYSA-N
MW370.45 g/mol
LogP1.20
Rot. Bonds5

About 2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide

2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide (PubChem CID 126953538) has the molecular formula C20H26N4O3 and a molecular weight of 370.45 g/mol. Its IUPAC name is 2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide
PubChem CID126953538
Molecular FormulaC20H26N4O3
Molecular Weight370.45 g/mol
Exact Mass370.20
IUPAC Name2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide
SMILESCN1CCC(N2CCC(Oc3cccc4c3ccn4CC(N)=O)CC2)C1=O
InChIInChI=1S/C20H26N4O3/c1-22-9-8-17(20(22)26)23-10-5-14(6-11-23)27-18-4-2-3-16-15(18)7-12-24(16)13-19(21)25/h2-4,7,12,14,17H,5-6,8-11,13H2,1H3,(H2,21,25)
InChIKeyHTZSKFJPWBDKOZ-UHFFFAOYSA-N
XLogP1.20
TPSA80.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide?
The IUPAC name of 2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide (CID 126953538) is 2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide.
What is the SMILES notation for 2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide?
The canonical SMILES for 2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide is CN1CCC(N2CCC(Oc3cccc4c3ccn4CC(N)=O)CC2)C1=O.
What is the InChIKey of 2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide?
The InChIKey is HTZSKFJPWBDKOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O3/c1-22-9-8-17(20(22)26)23-10-5-14(6-11-23)27-18-4-2-3-16-15(18)7-12-24(16)13-19(21)25/h2-4,7,12,14,17H,5-6,8-11,13H2,1H3,(H2,21,25).
What are the key properties of 2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide?
2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide has a molecular weight of 370.45 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[1-(1-methyl-2-oxopyrrolidin-3-yl)piperidin-4-yl]oxyindol-1-yl]acetamide is sourced from PubChem (CID 126953538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).