N-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide

C22H24N2O2 — CID 154838852

IUPACN-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESC=Cc1ccc(CCNC(=O)Cc2cccc(N3CCCC3=O)c2)cc1
InChIInChI=1S/C22H24N2O2/c1-2-17-8-10-18(11-9-17)12-13-23-21(25)16-19-5-3-6-20(15-19)24-14-4-7-22(24)26/h2-3,5-6,8-11,15H,1,4,7,12-14,16H2,(H,23,25)
InChIKeyHDJFKLKNEFJMLI-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.36
Rot. Bonds7

About N-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide

N-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide (PubChem CID 154838852) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is N-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
PubChem CID154838852
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC NameN-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESC=Cc1ccc(CCNC(=O)Cc2cccc(N3CCCC3=O)c2)cc1
InChIInChI=1S/C22H24N2O2/c1-2-17-8-10-18(11-9-17)12-13-23-21(25)16-19-5-3-6-20(15-19)24-14-4-7-22(24)26/h2-3,5-6,8-11,15H,1,4,7,12-14,16H2,(H,23,25)
InChIKeyHDJFKLKNEFJMLI-UHFFFAOYSA-N
XLogP3.36
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-aminophenyl)ethyl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 119548405
N-[2-[1-(methoxymethyl)cyclobutyl]ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 125143847
[2-[2-(4-chlorophenyl)ethylamino]-2-oxoethyl] 3-(2-oxopyrrolidin-1-yl)benzoate
CID 8728852
[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl] 3-(2-oxopyrrolidin-1-yl)benzoate
CID 8726499
4-(2-oxopyrrolidin-1-yl)-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide
CID 39003599
1-[2-(4-chlorophenyl)ethyl]-3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]thiourea
CID 9153806
3,3-dimethyl-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]butanamide
CID 39004153
(E)-3-[4-(2-oxopyrrolidin-1-yl)phenyl]-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]prop-2-enamide
CID 39002604
4-[[[3-(2-oxopyrrolidin-1-yl)phenyl]methylamino]methyl]benzoic acid
CID 122030295
N-(2-hydroxyethyl)-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 78823345
3-(2-aminophenyl)-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]propanamide;hydrochloride
CID 120609078
2-[4-(2-oxopyrrolidin-1-yl)phenyl]-N-(3-oxo-3-pyrrolidin-1-ylpropyl)acetamide
CID 18157169

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The IUPAC name of N-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide (CID 154838852) is N-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide.
What is the SMILES notation for N-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The canonical SMILES for N-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide is C=Cc1ccc(CCNC(=O)Cc2cccc(N3CCCC3=O)c2)cc1.
What is the InChIKey of N-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The InChIKey is HDJFKLKNEFJMLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-2-17-8-10-18(11-9-17)12-13-23-21(25)16-19-5-3-6-20(15-19)24-14-4-7-22(24)26/h2-3,5-6,8-11,15H,1,4,7,12-14,16H2,(H,23,25).
What are the key properties of N-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
N-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide has a molecular weight of 348.45 g/mol, XLogP of 3.36, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethenylphenyl)ethyl]-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 154838852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).