2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide

C19H19ClN2O2 — CID 17478499

IUPAC2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1)NCc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C19H19ClN2O2/c20-16-7-3-14(4-8-16)12-18(23)21-13-15-5-9-17(10-6-15)22-11-1-2-19(22)24/h3-10H,1-2,11-13H2,(H,21,23)
InChIKeyMRTOWKMTLLFHLZ-UHFFFAOYSA-N
MW342.83 g/mol
LogP3.33
Rot. Bonds5

About 2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide

2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide (PubChem CID 17478499) has the molecular formula C19H19ClN2O2 and a molecular weight of 342.83 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide
PubChem CID17478499
Molecular FormulaC19H19ClN2O2
Molecular Weight342.83 g/mol
Exact Mass342.11
IUPAC Name2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1)NCc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C19H19ClN2O2/c20-16-7-3-14(4-8-16)12-18(23)21-13-15-5-9-17(10-6-15)22-11-1-2-19(22)24/h3-10H,1-2,11-13H2,(H,21,23)
InChIKeyMRTOWKMTLLFHLZ-UHFFFAOYSA-N
XLogP3.33
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.83
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide (CID 17478499) is 2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide is O=C(Cc1ccc(Cl)cc1)NCc1ccc(N2CCCC2=O)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide?
The InChIKey is MRTOWKMTLLFHLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O2/c20-16-7-3-14(4-8-16)12-18(23)21-13-15-5-9-17(10-6-15)22-11-1-2-19(22)24/h3-10H,1-2,11-13H2,(H,21,23).
What are the key properties of 2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide?
2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide has a molecular weight of 342.83 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide is sourced from PubChem (CID 17478499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).