2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide

C21H22N2O2 — CID 26955686

IUPAC2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESO=C(Cc1ccc2c(c1)CCC2)Nc1ccccc1N1CCCC1=O
InChIInChI=1S/C21H22N2O2/c24-20(14-15-10-11-16-5-3-6-17(16)13-15)22-18-7-1-2-8-19(18)23-12-4-9-21(23)25/h1-2,7-8,10-11,13H,3-6,9,12,14H2,(H,22,24)
InChIKeyCRPINYNRROENSD-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.48
Rot. Bonds4

About 2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide

2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide (PubChem CID 26955686) has the molecular formula C21H22N2O2 and a molecular weight of 334.42 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
PubChem CID26955686
Molecular FormulaC21H22N2O2
Molecular Weight334.42 g/mol
Exact Mass334.17
IUPAC Name2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESO=C(Cc1ccc2c(c1)CCC2)Nc1ccccc1N1CCCC1=O
InChIInChI=1S/C21H22N2O2/c24-20(14-15-10-11-16-5-3-6-17(16)13-15)22-18-7-1-2-8-19(18)23-12-4-9-21(23)25/h1-2,7-8,10-11,13H,3-6,9,12,14H2,(H,22,24)
InChIKeyCRPINYNRROENSD-UHFFFAOYSA-N
XLogP3.48
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide (CID 26955686) is 2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide is O=C(Cc1ccc2c(c1)CCC2)Nc1ccccc1N1CCCC1=O.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The InChIKey is CRPINYNRROENSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O2/c24-20(14-15-10-11-16-5-3-6-17(16)13-15)22-18-7-1-2-8-19(18)23-12-4-9-21(23)25/h1-2,7-8,10-11,13H,3-6,9,12,14H2,(H,22,24).
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide has a molecular weight of 334.42 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 26955686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).